(Z)-8-[(2R,3R)-3-[(1Z,4Z)-deca-1,4-dienyl]thiiran-1-ium-2-yl]-8-oxidanylidene-oct-5-enoic acid

Systemtic Name: (Z)-8-[(2R,3R)-3-[(1Z,4Z)-deca-1,4-dienyl]thiiran-1-ium-2-yl]-8-oxidanylidene-oct-5-enoic acid Openeye Name: (Z)-8-[(2R,3R)-3-[(1Z,4Z)-deca-1,4-dienyl]thiiran-1-ium-2-yl]-8-oxo-oct-5-enoic acid CAS Name: (Z)-8-[(2R,3R)-3-[(1Z,4Z)-deca-1,4-dienyl]-2-thiiran-1-iumyl]-8-oxo-5-octenoic acid IUPAC Name: (Z)-8-[(2R,3R)-3-[(1Z,4Z)-deca-1,4-dienyl]thiiran-1-ium-2-yl]-8-oxooct-5-enoic acid Traditional Name: (Z)-8-[(2R,3R)-3-[(1Z,4Z)-deca-1,4-dienyl]thiiran-1-ium-2-yl]-8-keto-oct-5-enoic acid Formula: C20H31O3S+ MolecularWeight: 351.52334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CC1C([SH+]1)C(=O)CC=CCCCC(=O)O

Isomeric SMILES

CCCCC/C=C\C/C=C\[C@@H]1[C@H]([SH+]1)C(=O)C/C=C\CCCC(=O)O

InChI

InChI=1S/C20H30O3S/c1-2-3-4-5-6-7-8-12-15-18-20(24-18)17(21)14-11-9-10-13-16-19(22)23/h6-7,9,11-12,15,18,20H,2-5,8,10,13-14,16H2,1H3,(H,22,23)/p+1/b7-6-,11-9-,15-12-/t18-,20-/m1/s1