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

Systemtic Name: 4-[3-(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(6-ethoxy-2-oxo-1H-quinolin-3-yl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoic acid CAS Name: 4-[3-(6-ethoxy-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid IUPAC Name: 4-[3-(6-ethoxy-2-oxo-1H-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid Traditional Name: 4-[5-(6-ethoxy-2-keto-1H-quinolin-3-yl)-3-(p-tolyl)-2-pyrazolin-1-yl]-4-keto-butyric acid Formula: C25H25N3O5 MolecularWeight: 447.4831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)C3CC(=NN3C(=O)CCC(=O)O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H25N3O5/c1-3-33-18-8-9-20-17(12-18)13-19(25(32)26-20)22-14-21(16-6-4-15(2)5-7-16)27-28(22)23(29)10-11-24(30)31/h4-9,12-13,22H,3,10-11,14H2,1-2H3,(H,26,32)(H,30,31)