dimethyl 1-(2-methoxycarbonylthiophen-3-yl)-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-(2-methoxycarbonylthiophen-3-yl)-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-(2-methoxycarbonyl-3-thienyl)triazole-4,5-dicarboxylate CAS Name: 1-(2-methoxycarbonyl-3-thiophenyl)triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(2-methoxycarbonylthiophen-3-yl)triazole-4,5-dicarboxylate Traditional Name: 1-(2-carbomethoxy-3-thienyl)triazole-4,5-dicarboxylic acid dimethyl ester Formula: C12H11N3O6S MolecularWeight: 325.29724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)C2=C(SC=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(N=N1)C2=C(SC=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C12H11N3O6S/c1-19-10(16)7-8(11(17)20-2)15(14-13-7)6-4-5-22-9(6)12(18)21-3/h4-5H,1-3H3