3-(4-chlorophenyl)sulfonyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfonyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one CAS Name: 3-(4-chlorophenyl)sulfonyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfonyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Traditional Name: 3-(4-chlorophenyl)sulfonyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C20H22ClNO5S/c1-26-18-11-14-7-9-22(13-15(14)12-19(18)27-2)20(23)8-10-28(24,25)17-5-3-16(21)4-6-17/h3-6,11-12H,7-10,13H2,1-2H3