methyl 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)cyclohexyl]oxyphenyl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)cyclohexyl]oxyphenyl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)cyclohexoxy]phenyl]-4-oxo-butanoate CAS Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)cyclohexyl]oxyphenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)cyclohexyl]oxyphenyl]-4-oxobutanoate Traditional Name: 4-[4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)cyclohexoxy]phenyl]-4-keto-butyric acid methyl ester Formula: C28H34O7 MolecularWeight: 482.56536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OC2CCCC(C2)OC3=CC=C(C=C3)C(=O)CCC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OC2CCCC(C2)OC3=CC=C(C=C3)C(=O)CCC(=O)OC

InChI

InChI=1S/C28H34O7/c1-4-6-24-26(15-13-23(18(2)29)28(24)32)35-22-8-5-7-21(17-22)34-20-11-9-19(10-12-20)25(30)14-16-27(31)33-3/h9-13,15,21-22,32H,4-8,14,16-17H2,1-3H3