Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC([C@H]2O[C@H](CC(=O)N3CCC(=CC3)C(O)=O)C(=O)N(CC(C)(C)CO)C3=C2C=C(Cl)C=C3)=C1OC

InChIKey

InChIKey=XXVXHAQKYSQOFN-AOYPEHQESA-N

Formula

C30H35ClN2O8

Mass

587.07

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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 - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aryl chloride - Aryl halide - Hydropyridine - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Lactam - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Ether - Dialkyl ether - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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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