Structure Information
Structure

Compound Identification

SMILES

NC1=CC(=C2OCCNCC2=C1)C(F)(F)F.[O-][N+](=O)C1=CC(=C(F)C(C=O)=C1)C(F)(F)F

InChIKey

InChIKey=UBXFCPQBQRSENV-UHFFFAOYSA-N

Formula

C18H14F7N3O4

Mass

469.316

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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

Not available

Substituents

Nitrobenzaldehyde - Benzoxazepine - Trifluoromethylbenzene - Nitrobenzene - Benzaldehyde - Nitroaromatic compound - Benzoyl - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl-aldehyde - Aralkylamine - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Vinylogous halide - Organic nitro compound - C-nitro compound - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary aliphatic amine - Ether - Organic oxoazanium - Secondary amine - Alkyl fluoride - Aldehyde - Amine - Organic oxide - Organic oxygen compound - Alkyl halide - Hydrocarbon derivative - Organohalogen compound - Organic salt - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Organic cation - 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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