8-[4-[[1-(2-methoxyphenyl)-5-oxidanyl-3-oxidanylidene-2H-pyrrol-4-yl]carbonylamino]phenoxy]octanoic acid

Systemtic Name: 8-[4-[[1-(2-methoxyphenyl)-5-oxidanyl-3-oxidanylidene-2H-pyrrol-4-yl]carbonylamino]phenoxy]octanoic acid Openeye Name: 8-[4-[[5-hydroxy-1-(2-methoxyphenyl)-3-oxo-2H-pyrrole-4-carbonyl]amino]phenoxy]octanoic acid CAS Name: 8-[4-[[[5-hydroxy-1-(2-methoxyphenyl)-3-oxo-2H-pyrrol-4-yl]-oxomethyl]amino]phenoxy]octanoic acid IUPAC Name: 8-[4-[[5-hydroxy-1-(2-methoxyphenyl)-3-oxo-2H-pyrrole-4-carbonyl]amino]phenoxy]octanoic acid Traditional Name: 8-[4-[[2-hydroxy-4-keto-1-(2-methoxyphenyl)-2-pyrroline-3-carbonyl]amino]phenoxy]caprylic acid Formula: C26H30N2O7 MolecularWeight: 482.5256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC(=O)C(=C2O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CC(=O)C(=C2O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O

InChI

InChI=1S/C26H30N2O7/c1-34-22-10-7-6-9-20(22)28-17-21(29)24(26(28)33)25(32)27-18-12-14-19(15-13-18)35-16-8-4-2-3-5-11-23(30)31/h6-7,9-10,12-15,33H,2-5,8,11,16-17H2,1H3,(H,27,32)(H,30,31)