5-(1,3-dithian-2-ylmethyl)-6-methyl-hept-6-en-2-one

Systemtic Name: 5-(1,3-dithian-2-ylmethyl)-6-methyl-hept-6-en-2-one Openeye Name: 5-(1,3-dithian-2-ylmethyl)-6-methyl-hept-6-en-2-one CAS Name: 5-(1,3-dithian-2-ylmethyl)-6-methyl-6-hepten-2-one IUPAC Name: 5-(1,3-dithian-2-ylmethyl)-6-methylhept-6-en-2-one Traditional Name: 5-(1,3-dithian-2-ylmethyl)-6-methyl-hept-6-en-2-one Formula: C13H22OS2 MolecularWeight: 258.44318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(CCC(=O)C)CC1SCCCS1

Isomeric SMILES

CC(=C)C(CCC(=O)C)CC1SCCCS1

InChI

InChI=1S/C13H22OS2/c1-10(2)12(6-5-11(3)14)9-13-15-7-4-8-16-13/h12-13H,1,4-9H2,2-3H3