(E)-7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)thiolan-3-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)thiolan-3-yl]hept-5-enoic acid Openeye Name: (E)-7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)tetrahydrothiophen-3-yl]hept-5-enoic acid CAS Name: (E)-7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-thiolanyl]-5-heptenoic acid IUPAC Name: (E)-7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)thiolan-3-yl]hept-5-enoic acid Traditional Name: (E)-7-[4-(2,2-dimethyl-1,3-dioxolan-4-yl)tetrahydrothiophen-3-yl]hept-5-enoic acid Formula: C16H26O4S MolecularWeight: 314.44024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2CSCC2CC=CCCCC(=O)O)C

Isomeric SMILES

CC1(OCC(O1)C2CSCC2C/C=C/CCCC(=O)O)C

InChI

InChI=1S/C16H26O4S/c1-16(2)19-9-14(20-16)13-11-21-10-12(13)7-5-3-4-6-8-15(17)18/h3,5,12-14H,4,6-11H2,1-2H3,(H,17,18)/b5-3+