methyl 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]phenyl]-3,3-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]phenyl]-3,3-dimethyl-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]phenyl]-3,3-dimethyl-4-oxo-butanoate CAS Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenyl]-3,3-dimethyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenyl]-3,3-dimethyl-4-oxobutanoate Traditional Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]phenyl]-4-keto-3,3-dimethyl-butyric acid methyl ester Formula: C27H34O7 MolecularWeight: 470.55466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=C(C=C2)C(=O)C(C)(C)CC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=C(C=C2)C(=O)C(C)(C)CC(=O)OC

InChI

InChI=1S/C27H34O7/c1-6-8-22-23(14-13-21(18(2)28)25(22)30)34-16-7-15-33-20-11-9-19(10-12-20)26(31)27(3,4)17-24(29)32-5/h9-14,30H,6-8,15-17H2,1-5H3