4-[3-(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(6-methyl-2-oxo-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid CAS Name: 4-[3-(6-methyl-2-oxo-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid IUPAC Name: 4-[3-(6-methyl-2-oxo-1H-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[5-(2-keto-6-methyl-1H-quinolin-3-yl)-3-phenyl-2-pyrazolin-1-yl]butyric acid Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=CC=C4

InChI

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