(E,3S,6S)-2,2,7,7-tetramethyl-6-phenylsulfanyl-oct-4-en-3-ol

Systemtic Name: (E,3S,6S)-2,2,7,7-tetramethyl-6-phenylsulfanyl-oct-4-en-3-ol Openeye Name: (E,3S,6S)-2,2,7,7-tetramethyl-6-phenylsulfanyl-oct-4-en-3-ol CAS Name: (E,3S,6S)-2,2,7,7-tetramethyl-6-(phenylthio)-4-octen-3-ol IUPAC Name: (E,3S,6S)-2,2,7,7-tetramethyl-6-phenylsulfanyloct-4-en-3-ol Traditional Name: (E,3S,6S)-2,2,7,7-tetramethyl-6-(phenylthio)oct-4-en-3-ol Formula: C18H28OS MolecularWeight: 292.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C=CC(C(C)(C)C)SC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)[C@H](/C=C/[C@@H](C(C)(C)C)SC1=CC=CC=C1)O

InChI

InChI=1S/C18H28OS/c1-17(2,3)15(19)12-13-16(18(4,5)6)20-14-10-8-7-9-11-14/h7-13,15-16,19H,1-6H3/b13-12+/t15-,16-/m0/s1