[(E,2S)-7-(1,3-dithian-2-yl)hept-3-en-2-yl] ethanoate

Systemtic Name: [(E,2S)-7-(1,3-dithian-2-yl)hept-3-en-2-yl] ethanoate Openeye Name: [(E,1S)-6-(1,3-dithian-2-yl)-1-methyl-hex-2-enyl] acetate CAS Name: acetic acid [(E,2S)-7-(1,3-dithian-2-yl)hept-3-en-2-yl] ester IUPAC Name: [(E,2S)-7-(1,3-dithian-2-yl)hept-3-en-2-yl] acetate Traditional Name: acetic acid [(E,1S)-6-(1,3-dithian-2-yl)-1-methyl-hex-2-enyl] ester Formula: C13H22O2S2 MolecularWeight: 274.44258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CCCCC1SCCCS1)OC(=O)C

Isomeric SMILES

C[C@@H](/C=C/CCCC1SCCCS1)OC(=O)C

InChI

InChI=1S/C13H22O2S2/c1-11(15-12(2)14)7-4-3-5-8-13-16-9-6-10-17-13/h4,7,11,13H,3,5-6,8-10H2,1-2H3/b7-4+/t11-/m0/s1