1-[2-[bis(cyanomethyl)amino]ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-[bis(cyanomethyl)amino]ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-[bis(cyanomethyl)amino]ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-[bis(cyanomethyl)amino]ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-[bis(cyanomethyl)amino]ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-[bis(cyanomethyl)amino]ethyl]triazole-4-carboxylic acid Formula: C9H10N6O2 MolecularWeight: 234.2147

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=NN1CCN(CC#N)CC#N)C(=O)O

Isomeric SMILES

C1=C(N=NN1CCN(CC#N)CC#N)C(=O)O

InChI

InChI=1S/C9H10N6O2/c10-1-3-14(4-2-11)5-6-15-7-8(9(16)17)12-13-15/h7H,3-6H2,(H,16,17)