Structure Information
Structure

Compound Identification

SMILES

[Na+].CC1=CC2=C(C=C1C)N(C\C=C1/C3=CC=CC=C3COC3=C1C=C(C=C3)C([O-])=O)C=N2

InChIKey

InChIKey=KWELWDMCBFWKQN-CSFJJMQLSA-M

Formula

C26H21N2NaO3

Mass

432.455

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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 - Benzimidazole - Alkyl aryl ether - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Ether - Azacycle - Organic alkali metal salt - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic sodium salt - Organic salt - 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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