4-[[3-(1,2,4-triazol-4-yl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[3-(1,2,4-triazol-4-yl)phenyl]carbonylamino]benzoic acid Openeye Name: 4-[[3-(1,2,4-triazol-4-yl)benzoyl]amino]benzoic acid CAS Name: 4-[[oxo-[3-(1,2,4-triazol-4-yl)phenyl]methyl]amino]benzoic acid IUPAC Name: 4-[[3-(1,2,4-triazol-4-yl)benzoyl]amino]benzoic acid Traditional Name: 4-[[3-(1,2,4-triazol-4-yl)benzoyl]amino]benzoic acid Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C=NN=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N2C=NN=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12N4O3/c21-15(19-13-6-4-11(5-7-13)16(22)23)12-2-1-3-14(8-12)20-9-17-18-10-20/h1-10H,(H,19,21)(H,22,23)