[2-[[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[[5-(4-methylphenyl)-2-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-oxo-2-[[2-phenyl-5-(p-tolyl)pyrazol-3-yl]amino]ethyl] butanoate CAS Name: butanoic acid [2-[[5-(4-methylphenyl)-2-phenyl-3-pyrazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[5-(4-methylphenyl)-2-phenylpyrazol-3-yl]amino]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-keto-2-[[2-phenyl-5-(p-tolyl)pyrazol-3-yl]amino]ethyl] ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3/c1-3-7-22(27)28-15-21(26)23-20-14-19(17-12-10-16(2)11-13-17)24-25(20)18-8-5-4-6-9-18/h4-6,8-14H,3,7,15H2,1-2H3,(H,23,26)