4-[5-(4-bromophenyl)-3-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-(4-bromophenyl)-3-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-(4-bromophenyl)-3-(7-methyl-2-oxo-1H-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid CAS Name: 4-[5-(4-bromophenyl)-3-(7-methyl-2-oxo-1H-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid IUPAC Name: 4-[5-(4-bromophenyl)-3-(7-methyl-2-oxo-1H-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid Traditional Name: 4-[3-(4-bromophenyl)-5-(2-keto-7-methyl-1H-quinolin-3-yl)-2-pyrazolin-1-yl]-4-keto-butyric acid Formula: C23H20BrN3O4 MolecularWeight: 482.3266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H20BrN3O4/c1-13-2-3-15-11-17(23(31)25-18(15)10-13)20-12-19(14-4-6-16(24)7-5-14)26-27(20)21(28)8-9-22(29)30/h2-7,10-11,20H,8-9,12H2,1H3,(H,25,31)(H,29,30)