Structure Information
Structure

Compound Identification

SMILES

I.CC1=C(C=CC(=C1)[N+]([O-])=O)C(=O)N1C(CCCC2=C1C=CC(F)=C2)OCCCN1CCCC1

InChIKey

InChIKey=FEQIQJRDKVMUNI-UHFFFAOYSA-N

Formula

C25H31FIN3O4

Mass

583.443

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzazepine - Nitrobenzene - Benzamide - O-toluamide - Toluamide - Benzoic acid or derivatives - Nitrotoluene - Nitroaromatic compound - Benzoyl - Toluene - Azepine - N-alkylpyrrolidine - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Amino acid or derivatives - Organic nitro compound - Carboxamide group - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organopnictogen compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Amine - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organofluoride - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).

External Descriptors

Not available

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