6-ethylsulfanyl-7-methoxy-2-methyl-hept-5-en-3-yn-2-ol

Systemtic Name: 6-ethylsulfanyl-7-methoxy-2-methyl-hept-5-en-3-yn-2-ol Openeye Name: 6-ethylsulfanyl-7-methoxy-2-methyl-hept-5-en-3-yn-2-ol CAS Name: 6-(ethylthio)-7-methoxy-2-methyl-2-hept-5-en-3-ynol IUPAC Name: 6-ethylsulfanyl-7-methoxy-2-methylhept-5-en-3-yn-2-ol Traditional Name: 6-(ethylthio)-7-methoxy-2-methyl-hept-5-en-3-yn-2-ol Formula: C11H18O2S MolecularWeight: 214.32442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=CC#CC(C)(C)O)COC

Isomeric SMILES

CCSC(=CC#CC(C)(C)O)COC

InChI

InChI=1S/C11H18O2S/c1-5-14-10(9-13-4)7-6-8-11(2,3)12/h7,12H,5,9H2,1-4H3