3-[bis(fluoranyl)methyl]-N-(3-methoxypropyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonamide

Systemtic Name: 3-[bis(fluoranyl)methyl]-N-(3-methoxypropyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonamide Openeye Name: 3-(difluoromethyl)-N-(3-methoxypropyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide CAS Name: 3-(difluoromethyl)-N-(3-methoxypropyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide IUPAC Name: 3-(difluoromethyl)-N-(3-methoxypropyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide Traditional Name: 3-(difluoromethyl)-1-keto-N-(3-methoxypropyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide Formula: C14H18F2N2O4S MolecularWeight: 348.365526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18F2N2O4S/c1-22-6-2-5-17-23(20,21)10-4-3-9-7-12(13(15)16)18-14(19)11(9)8-10/h3-4,8,12-13,17H,2,5-7H2,1H3,(H,18,19)