5-[[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[2-(4-chlorophenyl)-5-methyl-4-phenyl-3-pyrazolyl]amino]-5-oxopentanoate IUPAC Name: 5-[[2-(4-chlorophenyl)-5-methyl-4-phenylpyrazol-3-yl]amino]-5-oxopentanoate Traditional Name: 5-[[2-(4-chlorophenyl)-5-methyl-4-phenyl-pyrazol-3-yl]amino]-5-keto-valerate Formula: C21H19ClN3O3- MolecularWeight: 396.84686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CCCC(=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=C1C2=CC=CC=C2)NC(=O)CCCC(=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClN3O3/c1-14-20(15-6-3-2-4-7-15)21(23-18(26)8-5-9-19(27)28)25(24-14)17-12-10-16(22)11-13-17/h2-4,6-7,10-13H,5,8-9H2,1H3,(H,23,26)(H,27,28)/p-1