dimethyl 2,3-bis(1,2,4-triazol-1-yl)butanedioate

Systemtic Name: dimethyl 2,3-bis(1,2,4-triazol-1-yl)butanedioate Openeye Name: dimethyl 2,3-bis(1,2,4-triazol-1-yl)butanedioate CAS Name: 2,3-bis(1,2,4-triazol-1-yl)butanedioic acid dimethyl ester IUPAC Name: dimethyl 2,3-bis(1,2,4-triazol-1-yl)butanedioate Traditional Name: 2,3-bis(1,2,4-triazol-1-yl)succinic acid dimethyl ester Formula: C10H12N6O4 MolecularWeight: 280.24008

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C(=O)OC)N1C=NC=N1)N2C=NC=N2

Isomeric SMILES

COC(=O)C(C(C(=O)OC)N1C=NC=N1)N2C=NC=N2

InChI

InChI=1S/C10H12N6O4/c1-19-9(17)7(15-5-11-3-13-15)8(10(18)20-2)16-6-12-4-14-16/h3-8H,1-2H3