3-(fluoranylmethyl)-1-oxidanylidene-N-phenethyl-3,4-dihydro-2H-isoquinoline-7-sulfonamide

Systemtic Name: 3-(fluoranylmethyl)-1-oxidanylidene-N-phenethyl-3,4-dihydro-2H-isoquinoline-7-sulfonamide Openeye Name: 3-(fluoromethyl)-1-oxo-N-phenethyl-3,4-dihydro-2H-isoquinoline-7-sulfonamide CAS Name: 3-(fluoromethyl)-1-oxo-N-phenethyl-3,4-dihydro-2H-isoquinoline-7-sulfonamide IUPAC Name: 3-(fluoromethyl)-1-oxo-N-phenethyl-3,4-dihydro-2H-isoquinoline-7-sulfonamide Traditional Name: 3-(fluoromethyl)-1-keto-N-phenethyl-3,4-dihydro-2H-isoquinoline-7-sulfonamide Formula: C18H19FN2O3S MolecularWeight: 362.418463

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C2=C1C=CC(=C2)S(=O)(=O)NCCC3=CC=CC=C3)CF

Isomeric SMILES

C1C(NC(=O)C2=C1C=CC(=C2)S(=O)(=O)NCCC3=CC=CC=C3)CF

InChI

InChI=1S/C18H19FN2O3S/c19-12-15-10-14-6-7-16(11-17(14)18(22)21-15)25(23,24)20-9-8-13-4-2-1-3-5-13/h1-7,11,15,20H,8-10,12H2,(H,21,22)