Compound Identification
SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCCC1CCCC2=C(C=CC(Cl)=C2)N1C(=O)C1=C(C)C=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=WNWFOXYZCOSJJC-UHFFFAOYSA-N
Formula
C27H27ClN2O6S
Mass
543.03
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
p-Methylbenzenesulfonates Benzenesulfonate esters Tosyl compounds o-Toluamides Arylsulfonic acids and derivatives Benzamides Nitrobenzenes Benzenesulfonyl compounds Nitrotoluenes Benzoyl derivatives Nitroaromatic compounds Azepines Organosulfonic acid esters Aryl chlorides Tertiary carboxylic acid amides Sulfonyls Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organic salts Organochlorides Organonitrogen compounds Organooxygen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-methylbenzenesulfonate - Benzazepine - Benzenesulfonate ester - Benzenesulfonate - Tosyl compound - Nitrobenzene - Benzoic acid or derivatives - Nitrotoluene - Arylsulfonic acid or derivatives - Benzamide - Toluamide - O-toluamide - Benzenesulfonyl group - Benzoyl - Nitroaromatic compound - Toluene - Azepine - Organosulfonic acid ester - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Sulfonyl - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Organosulfonic acid or derivatives - Organic nitro compound - Carboxamide group - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Organopnictogen compound - Organic nitrogen compound - Organosulfur compound - Organic salt - Organic oxide - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen 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