N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(trifluoromethyl)benzenesulfonamide Formula: C19H19F3N2O3S MolecularWeight: 412.42597

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O3S/c1-2-18(25)24-9-8-13-6-7-16(10-14(13)12-24)23-28(26,27)17-5-3-4-15(11-17)19(20,21)22/h3-7,10-11,23H,2,8-9,12H2,1H3