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

Systemtic Name: 4-[[3-(1,2,4-triazol-4-yl)phenyl]carbonylamino]benzoate Openeye Name: 4-[[3-(1,2,4-triazol-4-yl)benzoyl]amino]benzoate CAS Name: 4-[[oxo-[3-(1,2,4-triazol-4-yl)phenyl]methyl]amino]benzoate IUPAC Name: 4-[[3-(1,2,4-triazol-4-yl)benzoyl]amino]benzoate Traditional Name: 4-[[3-(1,2,4-triazol-4-yl)benzoyl]amino]benzoate Formula: C16H11N4O3- MolecularWeight: 307.28354

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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)/p-1