5-ethoxycarbonyl-2-(4-methoxyphenyl)-1,2,4-triazol-3-olate

Systemtic Name: 5-ethoxycarbonyl-2-(4-methoxyphenyl)-1,2,4-triazol-3-olate Openeye Name: 5-ethoxycarbonyl-2-(4-methoxyphenyl)-1,2,4-triazol-3-olate CAS Name: 5-ethoxycarbonyl-2-(4-methoxyphenyl)-1,2,4-triazol-3-olate IUPAC Name: 5-ethoxycarbonyl-2-(4-methoxyphenyl)-1,2,4-triazol-3-olate Traditional Name: 5-carbethoxy-2-(4-methoxyphenyl)-1,2,4-triazol-3-olate Formula: C12H12N3O4- MolecularWeight: 262.24138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=N1)[O-])C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=NN(C(=N1)[O-])C2=CC=C(C=C2)OC

InChI

InChI=1S/C12H13N3O4/c1-3-19-11(16)10-13-12(17)15(14-10)8-4-6-9(18-2)7-5-8/h4-7H,3H2,1-2H3,(H,13,14,17)/p-1