N-cyclobutyl-2-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide

Systemtic Name: N-cyclobutyl-2-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Openeye Name: N-cyclobutyl-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide CAS Name: N-cyclobutyl-2-(2,2,2-trifluoro-1-oxoethyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide IUPAC Name: N-cyclobutyl-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Traditional Name: N-cyclobutyl-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Formula: C15H17F3N2O3S MolecularWeight: 362.36729

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NS(=O)(=O)C2=CC3=C(CCN(C3)C(=O)C(F)(F)F)C=C2

Isomeric SMILES

C1CC(C1)NS(=O)(=O)C2=CC3=C(CCN(C3)C(=O)C(F)(F)F)C=C2

InChI

InChI=1S/C15H17F3N2O3S/c16-15(17,18)14(21)20-7-6-10-4-5-13(8-11(10)9-20)24(22,23)19-12-2-1-3-12/h4-5,8,12,19H,1-3,6-7,9H2