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

Systemtic Name: 8-[4-[(2-methyl-5-oxidanyl-3-oxidanylidene-1-phenyl-2H-pyrrol-4-yl)carbonylamino]phenoxy]octanoic acid Openeye Name: 8-[4-[(5-hydroxy-2-methyl-3-oxo-1-phenyl-2H-pyrrole-4-carbonyl)amino]phenoxy]octanoic acid CAS Name: 8-[4-[[(5-hydroxy-2-methyl-3-oxo-1-phenyl-2H-pyrrol-4-yl)-oxomethyl]amino]phenoxy]octanoic acid IUPAC Name: 8-[4-[(5-hydroxy-2-methyl-3-oxo-1-phenyl-2H-pyrrole-4-carbonyl)amino]phenoxy]octanoic acid Traditional Name: 8-[4-[(2-hydroxy-4-keto-5-methyl-1-phenyl-2-pyrroline-3-carbonyl)amino]phenoxy]caprylic acid Formula: C26H30N2O6 MolecularWeight: 466.5262

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C(=C(N1C2=CC=CC=C2)O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O

Isomeric SMILES

CC1C(=O)C(=C(N1C2=CC=CC=C2)O)C(=O)NC3=CC=C(C=C3)OCCCCCCCC(=O)O

InChI

InChI=1S/C26H30N2O6/c1-18-24(31)23(26(33)28(18)20-10-6-5-7-11-20)25(32)27-19-13-15-21(16-14-19)34-17-9-4-2-3-8-12-22(29)30/h5-7,10-11,13-16,18,33H,2-4,8-9,12,17H2,1H3,(H,27,32)(H,29,30)