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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazepines
Alternative Parents
Nitrobenzaldehydes Trifluoromethylbenzenes Benzaldehydes Benzoyl derivatives Nitroaromatic compounds Alkyl aryl ethers Fluorobenzenes Aralkylamines Aryl fluorides Vinylogous halides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkylamines Organic oxoazanium compounds Alkyl fluorides Organic salts Organofluorides Primary amines Hydrocarbon derivatives Organic oxides Organic cations
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