(E)-7-[4-(octylsulfanylmethyl)oxolan-3-yl]hept-2-enoic acid

Systemtic Name: (E)-7-[4-(octylsulfanylmethyl)oxolan-3-yl]hept-2-enoic acid Openeye Name: (E)-7-[4-(octylsulfanylmethyl)tetrahydrofuran-3-yl]hept-2-enoic acid CAS Name: (E)-7-[4-[(octylthio)methyl]-3-oxolanyl]-2-heptenoic acid IUPAC Name: (E)-7-[4-(octylsulfanylmethyl)oxolan-3-yl]hept-2-enoic acid Traditional Name: (E)-7-[4-[(octylthio)methyl]tetrahydrofuran-3-yl]hept-2-enoic acid Formula: C20H36O3S MolecularWeight: 356.56304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC1COCC1CCCCC=CC(=O)O

Isomeric SMILES

CCCCCCCCSCC1COCC1CCCC/C=C/C(=O)O

InChI

InChI=1S/C20H36O3S/c1-2-3-4-5-8-11-14-24-17-19-16-23-15-18(19)12-9-6-7-10-13-20(21)22/h10,13,18-19H,2-9,11-12,14-17H2,1H3,(H,21,22)/b13-10+