Compound Identification
SMILES
COC1=C(C=CC(N)=C1)C(=O)N1C(CCCC2=C1C=CC(F)=C2)OCCOS(=O)(=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=VOQNXLVDOYAWDO-UHFFFAOYSA-N
Formula
C27H29FN2O6S
Mass
528.6
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 Aminobenzoic acids and derivatives Aminophenyl ethers Arylsulfonic acids and derivatives Benzamides Benzenesulfonyl compounds Methoxyanilines Anisoles Phenoxy compounds Benzoyl derivatives Methoxybenzenes Azepines Alkyl aryl ethers Organosulfonic acid esters Aryl fluorides Tertiary carboxylic acid amides Sulfonyls Amino acids and derivatives Azacyclic compounds Organofluorides Primary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Benzenesulfonate ester - P-methylbenzenesulfonate - Aminobenzoic acid or derivatives - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Aminophenyl ether - Benzamide - Benzenesulfonyl group - Benzoic acid or derivatives - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Toluene - Azepine - Organosulfonic acid ester - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ether - Azacycle - Carboxylic acid derivative - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - 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