methyl 4-[4-[4-(3-acetyloxypropoxy)-2-oxidanyl-phenyl]carbonyl-3-oxidanyl-phenoxy]butanoate

Systemtic Name: methyl 4-[4-[4-(3-acetyloxypropoxy)-2-oxidanyl-phenyl]carbonyl-3-oxidanyl-phenoxy]butanoate Openeye Name: methyl 4-[4-[4-(3-acetoxypropoxy)-2-hydroxy-benzoyl]-3-hydroxy-phenoxy]butanoate CAS Name: 4-[4-[[4-(3-acetyloxypropoxy)-2-hydroxyphenyl]-oxomethyl]-3-hydroxyphenoxy]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[4-(3-acetyloxypropoxy)-2-hydroxybenzoyl]-3-hydroxyphenoxy]butanoate Traditional Name: 4-[4-[4-(3-acetoxypropoxy)-2-hydroxy-benzoyl]-3-hydroxy-phenoxy]butyric acid methyl ester Formula: C23H26O9 MolecularWeight: 446.44714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCOC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCC(=O)OC)O)O

Isomeric SMILES

CC(=O)OCCCOC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)OCCCC(=O)OC)O)O

InChI

InChI=1S/C23H26O9/c1-15(24)30-11-4-12-32-17-7-9-19(21(26)14-17)23(28)18-8-6-16(13-20(18)25)31-10-3-5-22(27)29-2/h6-9,13-14,25-26H,3-5,10-12H2,1-2H3