8-[4-[(6,7-dimethoxy-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]phenoxy]octanoic acid

Systemtic Name: 8-[4-[(6,7-dimethoxy-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]phenoxy]octanoic acid Openeye Name: 8-[4-[(2-hydroxy-6,7-dimethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]phenoxy]octanoic acid CAS Name: 8-[4-[[(2-hydroxy-6,7-dimethoxy-4-oxo-1H-quinolin-3-yl)-oxomethyl]amino]phenoxy]octanoic acid IUPAC Name: 8-[4-[(2-hydroxy-6,7-dimethoxy-4-oxo-1H-quinoline-3-carbonyl)amino]phenoxy]octanoic acid Traditional Name: 8-[4-[(2-hydroxy-4-keto-6,7-dimethoxy-1H-quinoline-3-carbonyl)amino]phenoxy]caprylic acid Formula: C26H30N2O8 MolecularWeight: 498.525

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(N2)O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C(=C(N2)O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O)OC

InChI

InChI=1S/C26H30N2O8/c1-34-20-14-18-19(15-21(20)35-2)28-26(33)23(24(18)31)25(32)27-16-9-11-17(12-10-16)36-13-7-5-3-4-6-8-22(29)30/h9-12,14-15H,3-8,13H2,1-2H3,(H,27,32)(H,29,30)(H2,28,31,33)