5-decyl-5-methyl-3-prop-2-enyl-3-propyl-thiolane-2,4-dione

Systemtic Name: 5-decyl-5-methyl-3-prop-2-enyl-3-propyl-thiolane-2,4-dione Openeye Name: 3-allyl-5-decyl-5-methyl-3-propyl-tetrahydrothiophene-2,4-dione CAS Name: 5-decyl-5-methyl-3-prop-2-enyl-3-propylthiolane-2,4-dione IUPAC Name: 5-decyl-5-methyl-3-prop-2-enyl-3-propylthiolane-2,4-dione Traditional Name: 3-allyl-5-decyl-5-methyl-3-propyl-tetrahydrothiophene-2,4-quinone Formula: C21H36O2S MolecularWeight: 352.57434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1(C(=O)C(C(=O)S1)(CCC)CC=C)C

Isomeric SMILES

CCCCCCCCCCC1(C(=O)C(C(=O)S1)(CCC)CC=C)C

InChI

InChI=1S/C21H36O2S/c1-5-8-9-10-11-12-13-14-17-20(4)18(22)21(15-6-2,16-7-3)19(23)24-20/h6H,2,5,7-17H2,1,3-4H3