Compound Identification
SMILES
NCC1=CC=CC(=C1)C1OC(CC(=O)NCC2=CC=CC=C2F)C(=O)N(CC=CC2=CC=CC=C2)C2=C1C=C(Cl)C=C2
InChIKey
InChIKey=FTWQVQOJOFMCAP-UHFFFAOYSA-N
Formula
C34H31ClFN3O3
Mass
584.09
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
Styrenes Phenylmethylamines Benzylamines Aralkylamines Fluorobenzenes Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Amino acids and derivatives Secondary carboxylic acid amides Lactams Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organic oxides Carbonyl compounds Organochlorides Organofluorides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Benzylamine - Phenylmethylamine - Styrene - Aralkylamine - Halobenzene - Fluorobenzene - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Aryl chloride - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Lactam - Carboxamide group - Amino acid or derivatives - Dialkyl ether - Ether - Carboxylic acid derivative - Azacycle - Oxacycle - Amine - Primary aliphatic amine - Organohalogen compound - Organochloride - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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