(4E)-5,9-dimethyl-1-[(1R,2S)-2-methyl-2-phenylsulfanyl-cyclobutyl]deca-4,8-dien-1-one

Systemtic Name: (4E)-5,9-dimethyl-1-[(1R,2S)-2-methyl-2-phenylsulfanyl-cyclobutyl]deca-4,8-dien-1-one Openeye Name: (4E)-5,9-dimethyl-1-[(1R,2S)-2-methyl-2-phenylsulfanyl-cyclobutyl]deca-4,8-dien-1-one CAS Name: (4E)-5,9-dimethyl-1-[(1R,2S)-2-methyl-2-(phenylthio)cyclobutyl]-1-deca-4,8-dienone IUPAC Name: (4E)-5,9-dimethyl-1-[(1R,2S)-2-methyl-2-phenylsulfanylcyclobutyl]deca-4,8-dien-1-one Traditional Name: (4E)-5,9-dimethyl-1-[(1R,2S)-2-methyl-2-(phenylthio)cyclobutyl]deca-4,8-dien-1-one Formula: C23H32OS MolecularWeight: 356.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=O)C1CCC1(C)SC2=CC=CC=C2)C)C

Isomeric SMILES

CC(=CCC/C(=C/CCC(=O)[C@H]1CC[C@]1(C)SC2=CC=CC=C2)/C)C

InChI

InChI=1S/C23H32OS/c1-18(2)10-8-11-19(3)12-9-15-22(24)21-16-17-23(21,4)25-20-13-6-5-7-14-20/h5-7,10,12-14,21H,8-9,11,15-17H2,1-4H3/b19-12+/t21-,23+/m1/s1