4-[(3S)-3-(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3S)-3-(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3S)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3S)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3S)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(5S)-5-(2-keto-8-methyl-1H-quinolin-3-yl)-3-(p-tolyl)-2-pyrazolin-1-yl]butyrate Formula: C24H22N3O4- MolecularWeight: 416.44918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=C(C(=CC=C4)C)NC3=O)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN([C@@H](C2)C3=CC4=C(C(=CC=C4)C)NC3=O)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C24H23N3O4/c1-14-6-8-16(9-7-14)19-13-20(27(26-19)21(28)10-11-22(29)30)18-12-17-5-3-4-15(2)23(17)25-24(18)31/h3-9,12,20H,10-11,13H2,1-2H3,(H,25,31)(H,29,30)/p-1/t20-/m0/s1