4-bromanyl-N-cyclopropyl-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-cyclopropyl-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]benzenesulfonamide Openeye Name: 4-bromo-N-cyclopropyl-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide CAS Name: 4-bromo-N-cyclopropyl-3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-cyclopropyl-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Traditional Name: 4-bromo-N-cyclopropyl-3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)benzenesulfonamide Formula: C21H23BrN2O5S MolecularWeight: 495.38672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4CC4)Br)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)NC4CC4)Br)OC

InChI

InChI=1S/C21H23BrN2O5S/c1-28-19-9-13-7-8-24(12-14(13)10-20(19)29-2)21(25)17-11-16(5-6-18(17)22)30(26,27)23-15-3-4-15/h5-6,9-11,15,23H,3-4,7-8,12H2,1-2H3