4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-chloro-N-(2-oxo-3-azepanyl)-N-[[2-(trifluoromethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(2-oxoazepan-3-yl)-N-[[2-(trifluoromethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-chloro-N-(2-ketoazepan-3-yl)-N-[2-(trifluoromethyl)benzyl]benzenesulfonamide Formula: C20H20ClF3N2O3S MolecularWeight: 460.89761

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClF3N2O3S/c21-15-8-10-16(11-9-15)30(28,29)26(18-7-3-4-12-25-19(18)27)13-14-5-1-2-6-17(14)20(22,23)24/h1-2,5-6,8-11,18H,3-4,7,12-13H2,(H,25,27)