(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-methyl-4-morpholinosulfonyl-pyrrol-2-yl)methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-methyl-4-morpholin-4-ylsulfonylpyrrol-2-yl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-methyl-4-morpholinosulfonyl-pyrrol-2-yl)methanone Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H27N3O6S/c1-22-14-17(31(26,27)24-6-8-30-9-7-24)12-18(22)21(25)23-5-4-15-10-19(28-2)20(29-3)11-16(15)13-23/h10-12,14H,4-9,13H2,1-3H3