dimethyl 1-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-[2-oxo-2-(2-oxochromen-3-yl)ethyl]triazole-4,5-dicarboxylate CAS Name: 1-[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-oxo-2-(2-oxochromen-3-yl)ethyl]triazole-4,5-dicarboxylate Traditional Name: 1-[2-keto-2-(2-ketochromen-3-yl)ethyl]triazole-4,5-dicarboxylic acid dimethyl ester Formula: C17H13N3O7 MolecularWeight: 371.30102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)CC(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(N=N1)CC(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)OC

InChI

InChI=1S/C17H13N3O7/c1-25-16(23)13-14(17(24)26-2)20(19-18-13)8-11(21)10-7-9-5-3-4-6-12(9)27-15(10)22/h3-7H,8H2,1-2H3