4-(1-oxidanyl-1-oxidanylidene-2-phenoxy-octan-4-yl)oxy-2-phenoxy-octanoic acid

Systemtic Name: 4-(1-oxidanyl-1-oxidanylidene-2-phenoxy-octan-4-yl)oxy-2-phenoxy-octanoic acid Openeye Name: 4-[1-(3-hydroxy-3-oxo-2-phenoxy-propyl)pentoxy]-2-phenoxy-octanoic acid CAS Name: 4-(1-hydroxy-1-oxo-2-phenoxyoctan-4-yl)oxy-2-phenoxyoctanoic acid IUPAC Name: 4-(1-hydroxy-1-oxo-2-phenoxyoctan-4-yl)oxy-2-phenoxyoctanoic acid Traditional Name: 4-[1-(3-hydroxy-3-keto-2-phenoxy-propyl)pentoxy]-2-phenoxy-caprylic acid Formula: C28H38O7 MolecularWeight: 486.59712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C(=O)O)OC1=CC=CC=C1)OC(CCCC)CC(C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CCCCC(CC(C(=O)O)OC1=CC=CC=C1)OC(CCCC)CC(C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C28H38O7/c1-3-5-13-23(19-25(27(29)30)34-21-15-9-7-10-16-21)33-24(14-6-4-2)20-26(28(31)32)35-22-17-11-8-12-18-22/h7-12,15-18,23-26H,3-6,13-14,19-20H2,1-2H3,(H,29,30)(H,31,32)