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

Systemtic Name: dimethyl 1-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]-1,2,3-triazole-4,5-dicarboxylate Openeye Name: dimethyl 1-[2-(4-isopropylanilino)-2-oxo-ethyl]triazole-4,5-dicarboxylate CAS Name: 1-[2-oxo-2-(4-propan-2-ylanilino)ethyl]triazole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[2-oxo-2-(4-propan-2-ylanilino)ethyl]triazole-4,5-dicarboxylate Traditional Name: 1-(2-cumidino-2-keto-ethyl)triazole-4,5-dicarboxylic acid dimethyl ester Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H20N4O5/c1-10(2)11-5-7-12(8-6-11)18-13(22)9-21-15(17(24)26-4)14(19-20-21)16(23)25-3/h5-8,10H,9H2,1-4H3,(H,18,22)