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

Systemtic Name: methyl 3-[[4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoate CAS Name: 3-[[oxo-[4-(1,2,4-triazol-1-yl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoate Traditional Name: 3-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoic acid methyl ester Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N4O3/c1-24-17(23)13-3-2-4-14(9-13)20-16(22)12-5-7-15(8-6-12)21-11-18-10-19-21/h2-11H,1H3,(H,20,22)