3,5-dimethyl-5-octyl-3-prop-2-enyl-thiolane-2,4-dione

Systemtic Name: 3,5-dimethyl-5-octyl-3-prop-2-enyl-thiolane-2,4-dione Openeye Name: 3-allyl-3,5-dimethyl-5-octyl-tetrahydrothiophene-2,4-dione CAS Name: 3,5-dimethyl-5-octyl-3-prop-2-enylthiolane-2,4-dione IUPAC Name: 3,5-dimethyl-5-octyl-3-prop-2-enylthiolane-2,4-dione Traditional Name: 3-allyl-3,5-dimethyl-5-octyl-tetrahydrothiophene-2,4-quinone Formula: C17H28O2S MolecularWeight: 296.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(C(=O)C(C(=O)S1)(C)CC=C)C

Isomeric SMILES

CCCCCCCCC1(C(=O)C(C(=O)S1)(C)CC=C)C

InChI

InChI=1S/C17H28O2S/c1-5-7-8-9-10-11-13-17(4)14(18)16(3,12-6-2)15(19)20-17/h6H,2,5,7-13H2,1,3-4H3