5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-8-methyl-quinoline

Systemtic Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-8-methyl-quinoline Openeye Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-8-methyl-quinoline CAS Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-8-methylquinoline IUPAC Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-8-methylquinoline Traditional Name: 5-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-8-methyl-quinoline Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)S(=O)(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)S(=O)(=O)N3CCC4=CC(=C(C=C4C3)OC)OC)C=CC=N2

InChI

InChI=1S/C21H22N2O4S/c1-14-6-7-20(17-5-4-9-22-21(14)17)28(24,25)23-10-8-15-11-18(26-2)19(27-3)12-16(15)13-23/h4-7,9,11-12H,8,10,13H2,1-3H3