2-[(6E,10E)-12-acetyloxy-2,6,10-trimethyl-dodeca-6,10-dienyl]sulfanylethyl ethanoate

Systemtic Name: 2-[(6E,10E)-12-acetyloxy-2,6,10-trimethyl-dodeca-6,10-dienyl]sulfanylethyl ethanoate Openeye Name: 2-[(6E,10E)-12-acetoxy-2,6,10-trimethyl-dodeca-6,10-dienyl]sulfanylethyl acetate CAS Name: acetic acid 2-[[(6E,10E)-12-acetyloxy-2,6,10-trimethyldodeca-6,10-dienyl]thio]ethyl ester IUPAC Name: 2-[(6E,10E)-12-acetyloxy-2,6,10-trimethyldodeca-6,10-dienyl]sulfanylethyl acetate Traditional Name: acetic acid 2-[[(6E,10E)-12-acetoxy-2,6,10-trimethyl-dodeca-6,10-dienyl]thio]ethyl ester Formula: C21H36O4S MolecularWeight: 384.57314

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(=CCCC(=CCOC(=O)C)C)C)CSCCOC(=O)C

Isomeric SMILES

CC(CCC/C(=C/CC/C(=C/COC(=O)C)/C)/C)CSCCOC(=O)C

InChI

InChI=1S/C21H36O4S/c1-17(8-6-10-18(2)12-13-24-20(4)22)9-7-11-19(3)16-26-15-14-25-21(5)23/h8,12,19H,6-7,9-11,13-16H2,1-5H3/b17-8+,18-12+