Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C2=C(C[C@H]3[C@@H]4N(C)[C@@H](CC5=C4C(O)=C(OC)C(C)=C5OC)[C@H](C#N)N3[C@H]2CNC(=O)C2=CC=C(Br)C=C2)C(OC)=C1C

InChIKey

InChIKey=VLRIUOQHEYZSEN-VEBUABNOSA-N

Formula

C35H39BrN4O7

Mass

707.622

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzazocines

Intermediate Tree Nodes

Not available

Direct Parent

Benzazocines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzazocine - Tetrahydroisoquinoline - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Phenol - Aralkylamine - N-methylpiperazine - N-alkylpiperazine - Piperazine - Aryl halide - Aryl bromide - 1,4-diazinane - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Alpha-aminonitrile - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Nitrile - Carbonitrile - Ether - Carboxylic acid derivative - Organic nitrogen compound - Amine - Organohalogen compound - Cyanide - Organic oxygen compound - Hydrocarbon derivative - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzazocines. These are organic compounds containing the benzazocine ring system, which consists of a benzene ring bound to an azocine ring.

External Descriptors

Not available

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