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

Systemtic Name: methyl 4-methyl-3-[[1-(phenylmethyl)-1,2,3-triazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 3-[(1-benzyltriazole-4-carbonyl)amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[oxo-[1-(phenylmethyl)-4-triazolyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-benzyltriazole-4-carbonyl)amino]-4-methylbenzoate Traditional Name: 3-[(1-benzyltriazole-4-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

InChI

InChI=1S/C19H18N4O3/c1-13-8-9-15(19(25)26-2)10-16(13)20-18(24)17-12-23(22-21-17)11-14-6-4-3-5-7-14/h3-10,12H,11H2,1-2H3,(H,20,24)