4-chloranyl-N-(4-ethoxyphenyl)-3-[3-(trifluoromethyl)piperidin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(4-ethoxyphenyl)-3-[3-(trifluoromethyl)piperidin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-chloro-N-(4-ethoxyphenyl)-3-[3-(trifluoromethyl)piperidine-1-carbonyl]benzenesulfonamide CAS Name: 4-chloro-N-(4-ethoxyphenyl)-3-[oxo-[3-(trifluoromethyl)-1-piperidinyl]methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(4-ethoxyphenyl)-3-[3-(trifluoromethyl)piperidine-1-carbonyl]benzenesulfonamide Traditional Name: 4-chloro-N-p-phenetyl-3-[3-(trifluoromethyl)piperidine-1-carbonyl]benzenesulfonamide Formula: C21H22ClF3N2O4S MolecularWeight: 490.92359

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCCC(C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCCC(C3)C(F)(F)F

InChI

InChI=1S/C21H22ClF3N2O4S/c1-2-31-16-7-5-15(6-8-16)26-32(29,30)17-9-10-19(22)18(12-17)20(28)27-11-3-4-14(13-27)21(23,24)25/h5-10,12,14,26H,2-4,11,13H2,1H3