[1-(4-methylsulfanylphenoxy)-5-oxidanylidene-hexan-3-yl] 3-(3-methoxybutanoyloxy)pentanoate

Systemtic Name: [1-(4-methylsulfanylphenoxy)-5-oxidanylidene-hexan-3-yl] 3-(3-methoxybutanoyloxy)pentanoate Openeye Name: [1-[2-(4-methylsulfanylphenoxy)ethyl]-3-oxo-butyl] 3-(3-methoxybutanoyloxy)pentanoate CAS Name: 3-(3-methoxy-1-oxobutoxy)pentanoic acid [1-[4-(methylthio)phenoxy]-5-oxohexan-3-yl] ester IUPAC Name: [1-(4-methylsulfanylphenoxy)-5-oxohexan-3-yl] 3-(3-methoxybutanoyloxy)pentanoate Traditional Name: 3-(3-methoxybutanoyloxy)valeric acid [3-keto-1-[2-[4-(methylthio)phenoxy]ethyl]butyl] ester Formula: C23H34O7S MolecularWeight: 454.57686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OC(CCOC1=CC=C(C=C1)SC)CC(=O)C)OC(=O)CC(C)OC

Isomeric SMILES

CCC(CC(=O)OC(CCOC1=CC=C(C=C1)SC)CC(=O)C)OC(=O)CC(C)OC

InChI

InChI=1S/C23H34O7S/c1-6-18(29-22(25)14-17(3)27-4)15-23(26)30-20(13-16(2)24)11-12-28-19-7-9-21(31-5)10-8-19/h7-10,17-18,20H,6,11-15H2,1-5H3