4-[4-[3-[2-methoxy-4-(2-methoxy-3-oxidanyl-3-oxidanylidene-propyl)phenoxy]propoxy]phenyl]benzoic acid

Systemtic Name: 4-[4-[3-[2-methoxy-4-(2-methoxy-3-oxidanyl-3-oxidanylidene-propyl)phenoxy]propoxy]phenyl]benzoic acid Openeye Name: 4-[4-[3-[4-(3-hydroxy-2-methoxy-3-oxo-propyl)-2-methoxy-phenoxy]propoxy]phenyl]benzoic acid CAS Name: 4-[4-[3-[4-(3-hydroxy-2-methoxy-3-oxopropyl)-2-methoxyphenoxy]propoxy]phenyl]benzoic acid IUPAC Name: 4-[4-[3-[4-(3-hydroxy-2-methoxy-3-oxopropyl)-2-methoxyphenoxy]propoxy]phenyl]benzoic acid Traditional Name: 4-[4-[3-[4-(3-hydroxy-3-keto-2-methoxy-propyl)-2-methoxy-phenoxy]propoxy]phenyl]benzoic acid Formula: C27H28O8 MolecularWeight: 480.50642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(C(=O)O)OC)OCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC(C(=O)O)OC)OCCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C27H28O8/c1-32-24-16-18(17-25(33-2)27(30)31)4-13-23(24)35-15-3-14-34-22-11-9-20(10-12-22)19-5-7-21(8-6-19)26(28)29/h4-13,16,25H,3,14-15,17H2,1-2H3,(H,28,29)(H,30,31)