Compound Identification
SMILES
COC1=C(C=CC(=C1)C(=O)N1CC2=CC=C(N2CC2=CC=CC=C12)C(=O)N1CCN(CCN2CCOCC2)CC1)N1C(C)=CC=C1C
InChIKey
InChIKey=PUICUTNGTZVBOC-UHFFFAOYSA-N
Formula
C37H44N6O4
Mass
636.797
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
1,4-benzodiazepines Benzamides Methoxyanilines Phenoxy compounds Methoxybenzenes 2-heteroaryl carboxamides Benzoyl derivatives Anisoles Pyrrole carboxamides N-alkylpiperazines Alkyl aryl ethers Morpholines Heteroaromatic compounds Tertiary carboxylic acid amides Trialkylamines Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - 1-phenylpyrrole - 1,4-benzodiazepine - Benzamide - Benzoic acid or derivatives - Methoxyaniline - 2-heteroaryl carboxamide - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Methoxybenzene - Alkyl aryl ether - N-alkylpiperazine - Benzenoid - 1,4-diazinane - Morpholine - Oxazinane - Piperazine - Monocyclic benzene moiety - Heteroaromatic compound - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Ether - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Organic nitrogen compound - Amine - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available