dimethyl 1-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]-1,2,3-triazole-4,5-dicarboxylate

Systemtic Name: dimethyl 1-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-[2-oxo-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylate CAS Name: 1-[2-oxo-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-oxo-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylate Traditional Name: 1-[2-keto-2-(4-phenoxyanilino)ethyl]triazole-4,5-dicarboxylic acid dimethyl ester Formula: C20H18N4O6 MolecularWeight: 410.38012

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(N=N1)CC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H18N4O6/c1-28-19(26)17-18(20(27)29-2)24(23-22-17)12-16(25)21-13-8-10-15(11-9-13)30-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3,(H,21,25)