1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-(3,4-dimethylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-(3,4-dimethylphenyl)piperidine-4-carboxamide Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(3,4-dimethylphenyl)piperidine-4-carboxamide CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(3,4-dimethylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(3,4-dimethylphenyl)piperidine-4-carboxamide Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(3,4-dimethylphenyl)isonipecotamide Formula: C21H22ClF3N2O3S MolecularWeight: 474.92419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F)C

InChI

InChI=1S/C21H22ClF3N2O3S/c1-13-3-4-16(11-14(13)2)26-20(28)15-7-9-27(10-8-15)31(29,30)17-5-6-19(22)18(12-17)21(23,24)25/h3-6,11-12,15H,7-10H2,1-2H3,(H,26,28)