| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:42 UTC |
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| Update Date | 2025-03-25 00:59:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02234933 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H9Cl2NO |
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| Molecular Mass | 217.0061 |
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| SMILES | Clc1ccc(OC2CNC2)c(Cl)c1 |
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| InChI Key | PMLDXMJQTBVTFZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | dichlorobenzenes |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alkyl aryl ethersaryl chloridesazacyclic compoundsazetidinesdialkylamineshydrocarbon derivativesorganochloridesorganopnictogen compoundsphenol ethersphenoxy compounds |
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| Substituents | phenol etheretheraromatic heteromonocyclic compoundorganochloridealkyl aryl etherorganohalogen compound1,3-dichlorobenzeneorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundaryl chloridesecondary aliphatic amineazacyclesecondary aminearyl halideazetidineorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundphenoxy compoundorganooxygen compoundamine |
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