5-[(5-carboxy-2-phenyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-[(5-carboxy-2-phenyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-[(5-carboxy-2-phenyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-1,2,4-triazole-3-carboxylic acid CAS Name: 5-[(5-carboxy-2-phenyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-[(5-carboxy-2-phenyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-[(5-carboxy-2-phenyl-1,2,4-triazol-3-yl)methyl]-1-phenyl-1,2,4-triazole-3-carboxylic acid Formula: C19H14N6O4 MolecularWeight: 390.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(=N2)C(=O)O)CC3=NC(=NN3C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)C(=O)O)CC3=NC(=NN3C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C19H14N6O4/c26-18(27)16-20-14(24(22-16)12-7-3-1-4-8-12)11-15-21-17(19(28)29)23-25(15)13-9-5-2-6-10-13/h1-10H,11H2,(H,26,27)(H,28,29)