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

Systemtic Name: 4-[(3R)-3-(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3R)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3R)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3R)-3-(8-methyl-2-oxo-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(5R)-5-(2-keto-8-methyl-1H-quinolin-3-yl)-3-phenyl-2-pyrazolin-1-yl]butyrate Formula: C23H20N3O4- MolecularWeight: 402.4226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)C3CC(=NN3C(=O)CCC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)[C@H]3CC(=NN3C(=O)CCC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O4/c1-14-6-5-9-16-12-17(23(30)24-22(14)16)19-13-18(15-7-3-2-4-8-15)25-26(19)20(27)10-11-21(28)29/h2-9,12,19H,10-11,13H2,1H3,(H,24,30)(H,28,29)/p-1/t19-/m1/s1