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

Systemtic Name: (E)-2,2,7,7-tetramethyl-6-phenylsulfanyl-oct-4-en-3-one Openeye Name: (E)-2,2,7,7-tetramethyl-6-phenylsulfanyl-oct-4-en-3-one CAS Name: (E)-2,2,7,7-tetramethyl-6-(phenylthio)-4-octen-3-one IUPAC Name: (E)-2,2,7,7-tetramethyl-6-phenylsulfanyloct-4-en-3-one Traditional Name: (E)-2,2,7,7-tetramethyl-6-(phenylthio)oct-4-en-3-one Formula: C18H26OS MolecularWeight: 290.46344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26OS/c1-17(2,3)15(19)12-13-16(18(4,5)6)20-14-10-8-7-9-11-14/h7-13,16H,1-6H3/b13-12+