5-azanyl-1-(4-cyano-2-phenyl-pyrazol-3-yl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-azanyl-1-(4-cyano-2-phenyl-pyrazol-3-yl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-amino-1-(4-cyano-2-phenyl-pyrazol-3-yl)triazole-4-carboxylic acid CAS Name: 5-amino-1-(4-cyano-2-phenyl-3-pyrazolyl)-4-triazolecarboxylic acid IUPAC Name: 5-amino-1-(4-cyano-2-phenylpyrazol-3-yl)triazole-4-carboxylic acid Traditional Name: 5-amino-1-(4-cyano-2-phenyl-pyrazol-3-yl)triazole-4-carboxylic acid Formula: C13H9N7O2 MolecularWeight: 295.25626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)N3C(=C(N=N3)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C#N)N3C(=C(N=N3)C(=O)O)N

InChI

InChI=1S/C13H9N7O2/c14-6-8-7-16-19(9-4-2-1-3-5-9)12(8)20-11(15)10(13(21)22)17-18-20/h1-5,7H,15H2,(H,21,22)