O2-ethyl O4-methyl 3-methyl-5-[2-[2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinolin-3-yl]carbonyloxypropanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-methyl 3-methyl-5-[2-[2-methyl-4-(4-methylphenyl)-1-oxidanylidene-isoquinolin-3-yl]carbonyloxypropanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-methyl 3-methyl-5-[2-[2-methyl-1-oxo-4-(p-tolyl)isoquinoline-3-carbonyl]oxypropanoylamino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[[2-methyl-4-(4-methylphenyl)-1-oxo-3-isoquinolinyl]-oxomethoxy]-1-oxopropyl]amino]thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester IUPAC Name: 2-O-ethyl 4-O-methyl 3-methyl-5-[2-[2-methyl-4-(4-methylphenyl)-1-oxoisoquinoline-3-carbonyl]oxypropanoylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-[2-[1-keto-2-methyl-4-(p-tolyl)isoquinoline-3-carbonyl]oxypropanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester Formula: C31H30N2O8S MolecularWeight: 590.6435

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)C)C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)C)C(=O)OC)C

InChI

InChI=1S/C31H30N2O8S/c1-7-40-31(38)25-17(3)22(29(36)39-6)27(42-25)32-26(34)18(4)41-30(37)24-23(19-14-12-16(2)13-15-19)20-10-8-9-11-21(20)28(35)33(24)5/h8-15,18H,7H2,1-6H3,(H,32,34)