6-chloranyl-3-oxidanylidene-2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-1H-isoindole-5-sulfonamide

Systemtic Name: 6-chloranyl-3-oxidanylidene-2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-1H-isoindole-5-sulfonamide Openeye Name: 6-chloro-3-oxo-2-[1-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidyl]isoindoline-5-sulfonamide CAS Name: 6-chloro-3-oxo-2-[1-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidinyl]-1H-isoindole-5-sulfonamide IUPAC Name: 6-chloro-3-oxo-2-[1-[[3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]-1H-isoindole-5-sulfonamide Traditional Name: 6-chloro-3-keto-2-[1-[3-(trifluoromethyl)benzyl]-4-piperidyl]isoindoline-5-sulfonamide Formula: C21H21ClF3N3O3S MolecularWeight: 487.92295

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC3=CC(=C(C=C3C2=O)S(=O)(=O)N)Cl)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCC1N2CC3=CC(=C(C=C3C2=O)S(=O)(=O)N)Cl)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H21ClF3N3O3S/c22-18-9-14-12-28(20(29)17(14)10-19(18)32(26,30)31)16-4-6-27(7-5-16)11-13-2-1-3-15(8-13)21(23,24)25/h1-3,8-10,16H,4-7,11-12H2,(H2,26,30,31)