4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]-4-oxo-butanoate CAS Name: 4-[(5-methyl-2,4-diphenyl-3-pyrazolyl)amino]-4-oxobutanoate IUPAC Name: 4-[(5-methyl-2,4-diphenylpyrazol-3-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]butyrate Formula: C20H18N3O3- MolecularWeight: 348.37522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O3/c1-14-19(15-8-4-2-5-9-15)20(21-17(24)12-13-18(25)26)23(22-14)16-10-6-3-7-11-16/h2-11H,12-13H2,1H3,(H,21,24)(H,25,26)/p-1