N-(3-methoxypropyl)-1-oxidanylidene-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide

Systemtic Name: N-(3-methoxypropyl)-1-oxidanylidene-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide Openeye Name: N-(3-methoxypropyl)-1-oxo-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide CAS Name: N-(3-methoxypropyl)-1-oxo-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide IUPAC Name: N-(3-methoxypropyl)-1-oxo-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide Traditional Name: 1-keto-N-(3-methoxypropyl)-3-(trifluoromethyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide Formula: C14H17F3N2O4S MolecularWeight: 366.35599

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNS(=O)(=O)C1=CC2=C(CC(NC2=O)C(F)(F)F)C=C1

Isomeric SMILES

COCCCNS(=O)(=O)C1=CC2=C(CC(NC2=O)C(F)(F)F)C=C1

InChI

InChI=1S/C14H17F3N2O4S/c1-23-6-2-5-18-24(21,22)10-4-3-9-7-12(14(15,16)17)19-13(20)11(9)8-10/h3-4,8,12,18H,2,5-7H2,1H3,(H,19,20)