Compound Identification
SMILES
COC1=C(NCC2=CC(O)=CC=C2)C=C(C=C1)C1=CC2=C(N1)C=NC=C2
InChIKey
InChIKey=QDZZVOAAGROABF-UHFFFAOYSA-N
Formula
C21H19N3O2
Mass
345.402
Taxonomic Classification
Taxonomy Tree
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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
Phenylmethylamines
- Level 5 Phenylbenzamines
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Subclass
Phenylmethylamines
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Phenylpyrroles Aminophenyl ethers Pyrrolopyridines Methoxyanilines Anisoles Benzylamines Methoxybenzenes Phenoxy compounds Phenylalkylamines 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Secondary alkylarylamines 1-hydroxy-2-unsubstituted benzenoids Pyridines and derivatives Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbenzamine - 2-phenylpyrrole - Pyrrolopyridine - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Phenol ether - Benzylamine - Anisole - Aralkylamine - Phenol - Alkyl aryl ether - Secondary aliphatic/aromatic amine - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Pyridine - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Ether - Secondary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available