[(E)-N-(4,5-dimethyl-1,2,3-triazol-1-yl)-C-phenyl-carbonimidoyl] 4-methylbenzoate

Systemtic Name: [(E)-N-(4,5-dimethyl-1,2,3-triazol-1-yl)-C-phenyl-carbonimidoyl] 4-methylbenzoate Openeye Name: [(E)-N-(4,5-dimethyltriazol-1-yl)-C-phenyl-carbonimidoyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(E)-(4,5-dimethyl-1-triazolyl)imino-phenylmethyl] ester IUPAC Name: [(E)-N-(4,5-dimethyltriazol-1-yl)-C-phenylcarbonimidoyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(E)-N-(4,5-dimethyltriazol-1-yl)-C-phenyl-carbonimidoyl] ester Formula: C19H18N4O2 MolecularWeight: 334.37182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC(=NN2C(=C(N=N2)C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O/C(=N/N2C(=C(N=N2)C)C)/C3=CC=CC=C3

InChI

InChI=1S/C19H18N4O2/c1-13-9-11-17(12-10-13)19(24)25-18(16-7-5-4-6-8-16)21-23-15(3)14(2)20-22-23/h4-12H,1-3H3/b21-18+