diethyl 2-acetamido-2-[(3-oxidanyl-1,2,3-triazol-4-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(3-oxidanyl-1,2,3-triazol-4-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(3-hydroxytriazol-4-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(3-hydroxy-4-triazolyl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(3-hydroxytriazol-4-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(3-hydroxytriazol-4-yl)methyl]malonic acid diethyl ester Formula: C12H18N4O6 MolecularWeight: 314.29452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN=NN1O)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CN=NN1O)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C12H18N4O6/c1-4-21-10(18)12(14-8(3)17,11(19)22-5-2)6-9-7-13-15-16(9)20/h7,20H,4-6H2,1-3H3,(H,14,17)