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

Systemtic Name: N-(3-bromanyl-4-ethoxy-phenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)benzenesulfonamide Openeye Name: N-(3-bromo-4-ethoxy-phenyl)-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide CAS Name: N-(3-bromo-4-ethoxyphenyl)-3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]benzenesulfonamide IUPAC Name: N-(3-bromo-4-ethoxyphenyl)-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Traditional Name: N-(3-bromo-4-ethoxy-phenyl)-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Formula: C24H23BrN2O4S MolecularWeight: 515.41942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC4=CC=CC=C4C3)Br

InChI

InChI=1S/C24H23BrN2O4S/c1-2-31-23-11-10-20(15-22(23)25)26-32(29,30)21-9-5-8-18(14-21)24(28)27-13-12-17-6-3-4-7-19(17)16-27/h3-11,14-15,26H,2,12-13,16H2,1H3