3,3-dimethyl-2-methylsulfanyl-4-(4-phenylbutyl)cyclopentan-1-one

Systemtic Name: 3,3-dimethyl-2-methylsulfanyl-4-(4-phenylbutyl)cyclopentan-1-one Openeye Name: 3,3-dimethyl-2-methylsulfanyl-4-(4-phenylbutyl)cyclopentanone CAS Name: 3,3-dimethyl-2-(methylthio)-4-(4-phenylbutyl)-1-cyclopentanone IUPAC Name: 3,3-dimethyl-2-methylsulfanyl-4-(4-phenylbutyl)cyclopentan-1-one Traditional Name: 3,3-dimethyl-2-(methylthio)-4-(4-phenylbutyl)cyclopentanone Formula: C18H26OS MolecularWeight: 290.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC(=O)C1SC)CCCCC2=CC=CC=C2)C

Isomeric SMILES

CC1(C(CC(=O)C1SC)CCCCC2=CC=CC=C2)C

InChI

InChI=1S/C18H26OS/c1-18(2)15(13-16(19)17(18)20-3)12-8-7-11-14-9-5-4-6-10-14/h4-6,9-10,15,17H,7-8,11-13H2,1-3H3