N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoranyl-2-methoxy-benzenesulfonamide

Systemtic Name: N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoranyl-2-methoxy-benzenesulfonamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoro-2-methoxy-benzenesulfonamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoro-2-methoxybenzenesulfonamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoro-2-methoxybenzenesulfonamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoro-2-methoxy-benzenesulfonamide Formula: C18H19FN2O4S MolecularWeight: 378.417863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C18H19FN2O4S/c1-12(22)21-8-7-13-3-5-16(9-14(13)11-21)20-26(23,24)18-10-15(19)4-6-17(18)25-2/h3-6,9-10,20H,7-8,11H2,1-2H3