Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC2=C3C(CCl)CN(C(=O)C4=CC5=CC(OC)=C(OC)C(OC)=C5N4)C3=CC(NCCN)=C2N1

InChIKey

InChIKey=GQOVTZTXQNQERS-UHFFFAOYSA-N

Formula

C27H30ClN5O6

Mass

556.02

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Pyrroloindoles

Intermediate Tree Nodes

Not available

Direct Parent

Pyrroloindoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indolecarboxamide derivative - Indolecarboxylic acid derivative - Pyrroloindole - Indole - 2-heteroaryl carboxamide - Anisole - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Methyl ester - Tertiary carboxylic acid amide - Pyrrole - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary amine - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Alkyl halide - Primary amine - Alkyl chloride - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrroloindoles. These are compounds containing a pyrroloindole moiety, which is a tricyclic heterocycle which consists of a pyrrole ring fused to an indole. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Indole is a bicyclic compound consisting of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.

External Descriptors

Not available

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