Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC(C)=C(C1C=C1C2=CC=CC=C2C2C(C3=CC=CC=C13)C2(F)F)C(=O)OCC#CC1=CN=CC=C1)C1=CC=C(C=C1)N1CCN(C)CC1

InChIKey

InChIKey=NDHYWRUWBJKGHQ-UHFFFAOYSA-N

Formula

C46H42F2N4O4

Mass

752.863

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Dibenzocycloheptenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzocycloheptenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzocycloheptene - Cinnamic acid or derivatives - Phenylpiperazine - N-arylpiperazine - Cinnamic acid ester - Dihydropyridinecarboxylic acid derivative - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Dihydropyridine - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Dicarboxylic acid or derivatives - Hydropyridine - Piperazine - Pyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Secondary amine - Organoheterocyclic compound - Enamine - Carboxylic acid derivative - Secondary aliphatic amine - Alkyl fluoride - Organic oxygen compound - Alkyl halide - Amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzocycloheptenes. These are compounds containing a dibenzocycloheptene moiety, which consists of two benzene rings connected by a cycloheptene ring.

External Descriptors

Not available

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