4-bromanyl-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-methoxy-N-methyl-benzenesulfonamide Openeye Name: 4-bromo-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-methoxy-N-methyl-benzenesulfonamide CAS Name: 4-bromo-3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-methoxy-N-methylbenzenesulfonamide IUPAC Name: 4-bromo-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-methoxy-N-methylbenzenesulfonamide Traditional Name: 4-bromo-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-methoxy-N-methyl-benzenesulfonamide Formula: C18H19BrN2O4S MolecularWeight: 439.32346

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Descriptors Computed from Structure

Canonical SMILES:

CN(OC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CN(OC)S(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H19BrN2O4S/c1-20(25-2)26(23,24)15-7-8-17(19)16(11-15)18(22)21-10-9-13-5-3-4-6-14(13)12-21/h3-8,11H,9-10,12H2,1-2H3