Structure Information
Structure

Compound Identification

SMILES

Cl.NC(=O)C=C.C[C@H]1[C@H]2CC3=C(C=C(OC(=O)C=C)C=C3)[C@]1(C)CCN2CC1=COC=C1

InChIKey

InChIKey=GZRZRWFFXFCMQV-DXIZSRMNSA-N

Formula

C25H31ClN2O4

Mass

458.98

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

6,7-benzomorphans

Subclass

2,6-dimethyl-3-benzazocines

Intermediate Tree Nodes

Not available

Direct Parent

2,6-dimethyl-3-benzazocines

Alternative Parents

Molecular Framework

Not available

Substituents

2,6-dimethyl-3-benzazocine - Benzazocine - Tetralin - Phenol ester - Aralkylamine - Benzenoid - Acrylic acid ester - Piperidine - Acrylic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Furan - Tertiary aliphatic amine - Primary carboxylic acid amide - Carboxamide group - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organooxygen compound - Carbonyl group - Hydrochloride - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2,6-dimethyl-3-benzazocines. These are aromatic compounds containing a 6,7-benzomorphan skeleton, which is substituted by methyl group at the 2- and 6-positions.

External Descriptors

Not available

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