dimethyl 1-(1-benzofuran-3-ylmethyl)-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-(1-benzofuran-3-ylmethyl)-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-(benzofuran-3-ylmethyl)triazole-4,5-dicarboxylate CAS Name: 1-(3-benzofuranylmethyl)triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(1-benzofuran-3-ylmethyl)triazole-4,5-dicarboxylate Traditional Name: 1-(benzofuran-3-ylmethyl)triazole-4,5-dicarboxylic acid dimethyl ester Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)CC2=COC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(N=N1)CC2=COC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C15H13N3O5/c1-21-14(19)12-13(15(20)22-2)18(17-16-12)7-9-8-23-11-6-4-3-5-10(9)11/h3-6,8H,7H2,1-2H3