Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C=C1)C(=C1CCN(CC3(C(C)C3C)C(O)=O)CC1)C1=C(OC2)C=CC(F)=C1

InChIKey

InChIKey=KRVXYJDPLKZJML-UHFFFAOYSA-N

Formula

C27H30FNO4

Mass

451.538

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxepines

Subclass

Dibenzoxepines

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzoxepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzoxepine - Anisole - Phenol ether - Alkyl aryl ether - Cyclopropanecarboxylic acid or derivatives - Aryl fluoride - Cyclopropanecarboxylic acid - Aryl halide - Benzenoid - Piperidine - Amino acid or derivatives - Amino acid - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid - Oxacycle - Carboxylic acid derivative - Azacycle - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzoxepines. These are compounds containing a dibenzoxepine moiety, which consists of two benzene connected by an oxazepine ring.

External Descriptors

Not available

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