2-hexadecyl-2,4-dimethyl-5-oxidanyl-thiophen-3-one

Systemtic Name: 2-hexadecyl-2,4-dimethyl-5-oxidanyl-thiophen-3-one Openeye Name: 2-hexadecyl-5-hydroxy-2,4-dimethyl-thiophen-3-one CAS Name: 2-hexadecyl-5-hydroxy-2,4-dimethyl-3-thiophenone IUPAC Name: 2-hexadecyl-5-hydroxy-2,4-dimethylthiophen-3-one Traditional Name: 2-cetyl-5-hydroxy-2,4-dimethyl-thiophen-3-one Formula: C22H40O2S MolecularWeight: 368.6168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1(C(=O)C(=C(S1)O)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC1(C(=O)C(=C(S1)O)C)C

InChI

InChI=1S/C22H40O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(3)20(23)19(2)21(24)25-22/h24H,4-18H2,1-3H3