Structure Information
Structure

Compound Identification

SMILES

CCC(=O)[N+](C)(C)CC1=CC(=CC=C1)C1=CC2=C3N(C)C=NC3=C(N=C2N1)N(C)C(=O)OC(C)(C)C

InChIKey

InChIKey=RKNTWBDVIRSBFE-UHFFFAOYSA-N

Formula

C27H35N6O3

Mass

491.615

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Substituted pyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrroles

Alternative Parents

Pyrrolopyridines Imidazo-[4,5-c]pyridines Pyridines and derivatives N-substituted imidazoles Imidolactams Benzene and substituted derivatives Quaternary ammonium salts Heteroaromatic compounds Carbamate esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylpyrrole - Imidazopyridine - Pyrrolopyridine - Imidazo-[4,5-c]pyridine - N-substituted imidazole - Pyridine - Imidolactam - Benzenoid - Monocyclic benzene moiety - Imidazole - Heteroaromatic compound - Azole - Quaternary ammonium salt - Carbamic acid ester - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic cation - 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

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