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

Systemtic Name: 4-bromanyl-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(2-methoxyethyl)benzenesulfonamide Openeye Name: 4-bromo-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-methoxyethyl)benzenesulfonamide CAS Name: 4-bromo-3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(2-methoxyethyl)benzenesulfonamide IUPAC Name: 4-bromo-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-methoxyethyl)benzenesulfonamide Traditional Name: 4-bromo-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-methoxyethyl)benzenesulfonamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

COCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

COCCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H21BrN2O4S/c1-26-11-9-21-27(24,25)16-6-7-18(20)17(12-16)19(23)22-10-8-14-4-2-3-5-15(14)13-22/h2-7,12,21H,8-11,13H2,1H3