ethyl (E)-7-[2-oxidanylidene-4-[(E)-1-(phenylmethyl)sulfinyloct-2-enyl]oxolan-3-yl]hept-5-enoate

Systemtic Name: ethyl (E)-7-[2-oxidanylidene-4-[(E)-1-(phenylmethyl)sulfinyloct-2-enyl]oxolan-3-yl]hept-5-enoate Openeye Name: ethyl (E)-7-[4-[(E)-1-benzylsulfinyloct-2-enyl]-2-oxo-tetrahydrofuran-3-yl]hept-5-enoate CAS Name: (E)-7-[2-oxo-4-[(E)-1-(phenylmethyl)sulfinyloct-2-enyl]-3-oxolanyl]-5-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[4-[(E)-1-benzylsulfinyloct-2-enyl]-2-oxooxolan-3-yl]hept-5-enoate Traditional Name: (E)-7-[4-[(E)-1-benzylsulfinyloct-2-enyl]-2-keto-tetrahydrofuran-3-yl]hept-5-enoic acid ethyl ester Formula: C28H40O5S MolecularWeight: 488.6792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(C1COC(=O)C1CC=CCCCC(=O)OCC)S(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCC/C=C/C(C1COC(=O)C1C/C=C/CCCC(=O)OCC)S(=O)CC2=CC=CC=C2

InChI

InChI=1S/C28H40O5S/c1-3-5-6-7-14-19-26(34(31)22-23-16-11-10-12-17-23)25-21-33-28(30)24(25)18-13-8-9-15-20-27(29)32-4-2/h8,10-14,16-17,19,24-26H,3-7,9,15,18,20-22H2,1-2H3/b13-8+,19-14+