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

Systemtic Name: N-pentyl-2-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Openeye Name: N-pentyl-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide CAS Name: N-pentyl-2-(2,2,2-trifluoro-1-oxoethyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide IUPAC Name: N-pentyl-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Traditional Name: N-amyl-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Formula: C16H21F3N2O3S MolecularWeight: 378.40975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNS(=O)(=O)C1=CC2=C(CCN(C2)C(=O)C(F)(F)F)C=C1

Isomeric SMILES

CCCCCNS(=O)(=O)C1=CC2=C(CCN(C2)C(=O)C(F)(F)F)C=C1

InChI

InChI=1S/C16H21F3N2O3S/c1-2-3-4-8-20-25(23,24)14-6-5-12-7-9-21(11-13(12)10-14)15(22)16(17,18)19/h5-6,10,20H,2-4,7-9,11H2,1H3