[2-[[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] 4-oxidanylidenepentanoate

Systemtic Name: [2-[[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] 4-oxidanylidenepentanoate Openeye Name: [2-[[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl] 4-oxopentanoate CAS Name: 4-oxopentanoic acid [2-[[5-(4-ethylphenyl)-2-phenyl-3-pyrazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[5-(4-ethylphenyl)-2-phenylpyrazol-3-yl]amino]-2-oxoethyl] 4-oxopentanoate Traditional Name: 4-ketovaleric acid [2-[[5-(4-ethylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl] ester Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)COC(=O)CCC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)COC(=O)CCC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C24H25N3O4/c1-3-18-10-12-19(13-11-18)21-15-22(27(26-21)20-7-5-4-6-8-20)25-23(29)16-31-24(30)14-9-17(2)28/h4-8,10-13,15H,3,9,14,16H2,1-2H3,(H,25,29)