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

Systemtic Name: methyl 2-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]benzoate CAS Name: 2-[[oxo-[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]benzoate Traditional Name: 2-[[4-(1,2,4-triazol-1-ylmethyl)benzoyl]amino]benzoic acid methyl ester Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C18H16N4O3/c1-25-18(24)15-4-2-3-5-16(15)21-17(23)14-8-6-13(7-9-14)10-22-12-19-11-20-22/h2-9,11-12H,10H2,1H3,(H,21,23)