methyl 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]thiophene-2-carboxylate CAS Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]thiophene-2-carboxylate Traditional Name: 3-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]thiophene-2-carboxylic acid methyl ester Formula: C17H19NO6S2 MolecularWeight: 397.46586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=C(SC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)S(=O)(=O)C3=C(SC=C3)C(=O)OC)OC

InChI

InChI=1S/C17H19NO6S2/c1-22-13-8-11-4-6-18(10-12(11)9-14(13)23-2)26(20,21)15-5-7-25-16(15)17(19)24-3/h5,7-9H,4,6,10H2,1-3H3