methyl (2E,6E,10S,11S)-7-ethyl-3,11-dimethyl-10-methylsulfonyloxy-11-oxidanyl-trideca-2,6-dienoate

Systemtic Name: methyl (2E,6E,10S,11S)-7-ethyl-3,11-dimethyl-10-methylsulfonyloxy-11-oxidanyl-trideca-2,6-dienoate Openeye Name: methyl (2E,6E,10S,11S)-7-ethyl-11-hydroxy-3,11-dimethyl-10-methylsulfonyloxy-trideca-2,6-dienoate CAS Name: (2E,6E,10S,11S)-7-ethyl-11-hydroxy-3,11-dimethyl-10-methylsulfonyloxytrideca-2,6-dienoic acid methyl ester IUPAC Name: methyl (2E,6E,10S,11S)-7-ethyl-11-hydroxy-3,11-dimethyl-10-methylsulfonyloxytrideca-2,6-dienoate Traditional Name: (2E,6E,10S,11S)-7-ethyl-11-hydroxy-3,11-dimethyl-10-methylsulfonyloxy-trideca-2,6-dienoic acid methyl ester Formula: C19H34O6S MolecularWeight: 390.53466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CCCC(=CC(=O)OC)C)CCC(C(C)(CC)O)OS(=O)(=O)C

Isomeric SMILES

CC/C(=C\CC/C(=C/C(=O)OC)/C)/CC[C@@H]([C@](C)(CC)O)OS(=O)(=O)C

InChI

InChI=1S/C19H34O6S/c1-7-16(11-9-10-15(3)14-18(20)24-5)12-13-17(19(4,21)8-2)25-26(6,22)23/h11,14,17,21H,7-10,12-13H2,1-6H3/b15-14+,16-11+/t17-,19-/m0/s1