ethyl (E)-7-[3-[(E)-1-methylsulfanyloct-2-enyl]-2-oxidanylidene-oxolan-3-yl]hept-5-enoate

Systemtic Name: ethyl (E)-7-[3-[(E)-1-methylsulfanyloct-2-enyl]-2-oxidanylidene-oxolan-3-yl]hept-5-enoate Openeye Name: ethyl (E)-7-[3-[(E)-1-methylsulfanyloct-2-enyl]-2-oxo-tetrahydrofuran-3-yl]hept-5-enoate CAS Name: (E)-7-[3-[(E)-1-(methylthio)oct-2-enyl]-2-oxo-3-oxolanyl]-5-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[3-[(E)-1-methylsulfanyloct-2-enyl]-2-oxooxolan-3-yl]hept-5-enoate Traditional Name: (E)-7-[2-keto-3-[(E)-1-(methylthio)oct-2-enyl]tetrahydrofuran-3-yl]hept-5-enoic acid ethyl ester Formula: C22H36O4S MolecularWeight: 396.58384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(C1(CCOC1=O)CC=CCCCC(=O)OCC)SC

Isomeric SMILES

CCCCC/C=C/C(C1(CCOC1=O)C/C=C/CCCC(=O)OCC)SC

InChI

InChI=1S/C22H36O4S/c1-4-6-7-8-11-14-19(27-3)22(17-18-26-21(22)24)16-13-10-9-12-15-20(23)25-5-2/h10-11,13-14,19H,4-9,12,15-18H2,1-3H3/b13-10+,14-11+