1-[(E)-but-2-enyl]sulfanyl-2,6-dimethyl-heptan-4-one

Systemtic Name: 1-[(E)-but-2-enyl]sulfanyl-2,6-dimethyl-heptan-4-one Openeye Name: 1-[(E)-but-2-enyl]sulfanyl-2,6-dimethyl-heptan-4-one CAS Name: 1-[[(E)-but-2-enyl]thio]-2,6-dimethyl-4-heptanone IUPAC Name: 1-[(E)-but-2-enyl]sulfanyl-2,6-dimethylheptan-4-one Traditional Name: 1-[[(E)-but-2-enyl]thio]-2,6-dimethyl-heptan-4-one Formula: C13H24OS MolecularWeight: 228.39406

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCSCC(C)CC(=O)CC(C)C

Isomeric SMILES

C/C=C/CSCC(C)CC(=O)CC(C)C

InChI

InChI=1S/C13H24OS/c1-5-6-7-15-10-12(4)9-13(14)8-11(2)3/h5-6,11-12H,7-10H2,1-4H3/b6-5+