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

Systemtic Name: methyl 4-methyl-3-[(2-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[(2-phenyltriazole-4-carbonyl)amino]benzoate CAS Name: 4-methyl-3-[[oxo-(2-phenyl-4-triazolyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(2-phenyltriazole-4-carbonyl)amino]benzoate Traditional Name: 4-methyl-3-[(2-phenyltriazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H16N4O3/c1-12-8-9-13(18(24)25-2)10-15(12)20-17(23)16-11-19-22(21-16)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,20,23)