methyl 4-[[2-(1,2,4-triazol-4-yl)pyridin-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[2-(1,2,4-triazol-4-yl)pyridin-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(1,2,4-triazol-4-yl)pyridine-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[2-(1,2,4-triazol-4-yl)-4-pyridinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(1,2,4-triazol-4-yl)pyridine-4-carbonyl]amino]benzoate Traditional Name: 4-[[2-(1,2,4-triazol-4-yl)isonicotinoyl]amino]benzoic acid methyl ester Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC=C2)N3C=NN=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC=C2)N3C=NN=C3

InChI

InChI=1S/C16H13N5O3/c1-24-16(23)11-2-4-13(5-3-11)20-15(22)12-6-7-17-14(8-12)21-9-18-19-10-21/h2-10H,1H3,(H,20,22)