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

Systemtic Name: methyl 3-[[2-(1,2,4-triazol-1-yl)pyridin-3-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[2-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(1,2,4-triazol-1-yl)pyridine-3-carbonyl]amino]benzoate Traditional Name: 3-[[2-(1,2,4-triazol-1-yl)nicotinoyl]amino]benzoic acid methyl ester Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)N3C=NC=N3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)N3C=NC=N3

InChI

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