[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[(2,5-diphenyl-3-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-[(2,5-diphenylpyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)NC1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)OCC(=O)NC1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-2-9-21(26)27-15-20(25)22-19-14-18(16-10-5-3-6-11-16)23-24(19)17-12-7-4-8-13-17/h3-8,10-14H,2,9,15H2,1H3,(H,22,25)