8-[4-[(7-methoxycarbonyl-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]phenoxy]octanoic acid

Systemtic Name: 8-[4-[(7-methoxycarbonyl-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]phenoxy]octanoic acid Openeye Name: 8-[4-[(2-hydroxy-7-methoxycarbonyl-4-oxo-1H-quinoline-3-carbonyl)amino]phenoxy]octanoic acid CAS Name: 8-[4-[[(2-hydroxy-7-methoxycarbonyl-4-oxo-1H-quinolin-3-yl)-oxomethyl]amino]phenoxy]octanoic acid IUPAC Name: 8-[4-[(2-hydroxy-7-methoxycarbonyl-4-oxo-1H-quinoline-3-carbonyl)amino]phenoxy]octanoic acid Traditional Name: 8-[4-[(7-carbomethoxy-2-hydroxy-4-keto-1H-quinoline-3-carbonyl)amino]phenoxy]caprylic acid Formula: C26H28N2O8 MolecularWeight: 496.50912

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)C(=C(N2)O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)C(=C(N2)O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O

InChI

InChI=1S/C26H28N2O8/c1-35-26(34)16-8-13-19-20(15-16)28-25(33)22(23(19)31)24(32)27-17-9-11-18(12-10-17)36-14-6-4-2-3-5-7-21(29)30/h8-13,15H,2-7,14H2,1H3,(H,27,32)(H,29,30)(H2,28,31,33)