8-[4-[[8-(4-methoxyphenyl)-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl]carbonylamino]phenoxy]octanoic acid

Systemtic Name: 8-[4-[[8-(4-methoxyphenyl)-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl]carbonylamino]phenoxy]octanoic acid Openeye Name: 8-[4-[[2-hydroxy-8-(4-methoxyphenyl)-4-oxo-1H-quinoline-3-carbonyl]amino]phenoxy]octanoic acid CAS Name: 8-[4-[[[2-hydroxy-8-(4-methoxyphenyl)-4-oxo-1H-quinolin-3-yl]-oxomethyl]amino]phenoxy]octanoic acid IUPAC Name: 8-[4-[[2-hydroxy-8-(4-methoxyphenyl)-4-oxo-1H-quinoline-3-carbonyl]amino]phenoxy]octanoic acid Traditional Name: 8-[4-[[2-hydroxy-4-keto-8-(4-methoxyphenyl)-1H-quinoline-3-carbonyl]amino]phenoxy]caprylic acid Formula: C31H32N2O7 MolecularWeight: 544.59498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=CC3=C2NC(=C(C3=O)C(=O)NC4=CC=C(C=C4)OCCCCCCCC(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=CC3=C2NC(=C(C3=O)C(=O)NC4=CC=C(C=C4)OCCCCCCCC(=O)O)O

InChI

InChI=1S/C31H32N2O7/c1-39-22-15-11-20(12-16-22)24-8-7-9-25-28(24)33-31(38)27(29(25)36)30(37)32-21-13-17-23(18-14-21)40-19-6-4-2-3-5-10-26(34)35/h7-9,11-18H,2-6,10,19H2,1H3,(H,32,37)(H,34,35)(H2,33,36,38)