[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2,5-diphenylpyrazole-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 2,5-diphenylpyrazole-3-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 2,5-diphenylpyrazole-3-carboxylate CAS Name: 2,5-diphenyl-3-pyrazolecarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 2,5-diphenylpyrazole-3-carboxylate Traditional Name: 2,5-diphenylpyrazole-3-carboxylic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O3/c1-3-10-17(2)24-22(27)16-29-23(28)21-15-20(18-11-6-4-7-12-18)25-26(21)19-13-8-5-9-14-19/h4-9,11-15,17H,3,10,16H2,1-2H3,(H,24,27)