(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 1,5-diphenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 1,5-diphenyl-1,2,4-triazole-3-carboxylate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 1,5-diphenyl-1,2,4-triazole-3-carboxylate CAS Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 1,5-diphenyl-1,2,4-triazole-3-carboxylate Traditional Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=NN(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3/c26-18(24-13-7-8-14-24)15-28-21(27)19-22-20(16-9-3-1-4-10-16)25(23-19)17-11-5-2-6-12-17/h1-6,9-12H,7-8,13-15H2