Structure Information
Structure

Compound Identification

SMILES

CC(=O)[C@]1(CNCC[C@H]1[N+]1(CC(C)(C)C)C2=C(C=C(Cl)C=C2)C(OCC1=O)C1=CC=CC2=CC=CC=C12)C(O)=O

InChIKey

InChIKey=DNJRYLULVKYISB-KMBBXXALSA-O

Formula

C32H36ClN2O5

Mass

564.1

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoxazepine - Naphthalene - Piperidinecarboxylic acid - Beta-keto acid - Aryl chloride - Aryl halide - Beta-aminoketone - Benzenoid - Beta-hydroxy ketone - Keto acid - Piperidine - Amino acid or derivatives - Amino acid - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Secondary aliphatic amine - Ether - Secondary amine - Monocarboxylic acid or derivatives - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazepines. These are organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).

External Descriptors

Not available

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