Structure Information
Structure

Compound Identification

SMILES

COC1=C(OCCCCCOC2=C(OC)C=C3C(=C2)N=C[C@@H]2CCCN2C3=O)C=C2NC[C@@H]3CCCN3C(=O)C2=C1

InChIKey

InChIKey=RWZMDZPJEOYCMB-SFTDATJTSA-N

Formula

C31H38N4O6

Mass

562.667

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

1,4-benzodiazepines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrrolo[2,1-c][1,4]benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrrolo[2,1-c][1,4]benzodizepine - Anisole - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Benzenoid - Pyrrolidine - Tertiary carboxylic acid amide - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Lactam - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Secondary amine - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organonitrogen compound - Imine - Organooxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrrolo[2,1-c][1,4]benzodiazepines. These are heterocyclic aromatic compounds containing a 1,4-benzodiazepine ring system that is fused to, and shared a nitrogen atom with a pyrrole ring.

External Descriptors

Not available

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