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

Systemtic Name: [(E)-N-(4,5-dimethyl-1,2,3-triazol-1-yl)-C-phenyl-carbonimidoyl] 4-chloranylbenzoate Openeye Name: [(E)-N-(4,5-dimethyltriazol-1-yl)-C-phenyl-carbonimidoyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(E)-(4,5-dimethyl-1-triazolyl)imino-phenylmethyl] ester IUPAC Name: [(E)-N-(4,5-dimethyltriazol-1-yl)-C-phenylcarbonimidoyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(E)-N-(4,5-dimethyltriazol-1-yl)-C-phenyl-carbonimidoyl] ester Formula: C18H15ClN4O2 MolecularWeight: 354.7903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=N1)N=C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(N(N=N1)/N=C(\C2=CC=CC=C2)/OC(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C18H15ClN4O2/c1-12-13(2)23(22-20-12)21-17(14-6-4-3-5-7-14)25-18(24)15-8-10-16(19)11-9-15/h3-11H,1-2H3/b21-17+