4-[2-[3-butanoyl-4-[(2-methylphenyl)amino]quinolin-8-yl]oxyethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[3-butanoyl-4-[(2-methylphenyl)amino]quinolin-8-yl]oxyethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[[3-butanoyl-4-(2-methylanilino)-8-quinolyl]oxy]ethoxy]-4-oxo-butanoic acid CAS Name: 4-[2-[[4-(2-methylanilino)-3-(1-oxobutyl)-8-quinolinyl]oxy]ethoxy]-4-oxobutanoic acid IUPAC Name: 4-[2-[3-butanoyl-4-(2-methylanilino)quinolin-8-yl]oxyethoxy]-4-oxobutanoic acid Traditional Name: 4-[2-[[3-butyryl-4-(o-toluidino)-8-quinolyl]oxy]ethoxy]-4-keto-butyric acid Formula: C26H28N2O6 MolecularWeight: 464.51032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2OCCOC(=O)CCC(=O)O

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2OCCOC(=O)CCC(=O)O

InChI

InChI=1S/C26H28N2O6/c1-3-7-21(29)19-16-27-26-18(25(19)28-20-10-5-4-8-17(20)2)9-6-11-22(26)33-14-15-34-24(32)13-12-23(30)31/h4-6,8-11,16H,3,7,12-15H2,1-2H3,(H,27,28)(H,30,31)