Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)CC([NH+]2CCN(CC2)C2=CC=CC=C2Cl)C1=O
InChIKey
InChIKey=MJNTZINAKTYUAP-UHFFFAOYSA-O
Formula
C21H23ClN3O3
Mass
400.88
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Phenylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperazines
Alternative Parents
N-arylpiperazines Phenylpyrrolidines Alpha amino acids and derivatives Methoxyanilines Anisoles Dialkylarylamines Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Chlorobenzenes N-alkylpiperazines Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Quaternary ammonium salts Pyrroles Dicarboximides Lactams Trialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - 1-phenylpyrrolidine - Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Alkyl aryl ether - N-alkylpiperazine - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Quaternary ammonium salt - Pyrrolidine - Pyrrole - Carboxylic acid imide - Dicarboximide - Amino acid or derivatives - Lactam - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Carboxylic acid derivative - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors
Not available