butyl 2-cyclohexyl-2-sulfanyl-pentanoate

Systemtic Name: butyl 2-cyclohexyl-2-sulfanyl-pentanoate Openeye Name: butyl 2-cyclohexyl-2-sulfanyl-pentanoate CAS Name: 2-cyclohexyl-2-mercaptopentanoic acid butyl ester IUPAC Name: butyl 2-cyclohexyl-2-sulfanylpentanoate Traditional Name: 2-cyclohexyl-2-mercapto-valeric acid butyl ester Formula: C15H28O2S MolecularWeight: 272.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CCC)(C1CCCCC1)S

Isomeric SMILES

CCCCOC(=O)C(CCC)(C1CCCCC1)S

InChI

InChI=1S/C15H28O2S/c1-3-5-12-17-14(16)15(18,11-4-2)13-9-7-6-8-10-13/h13,18H,3-12H2,1-2H3