2-(cyclohexylsulfanylmethyl)benzoate

Systemtic Name: 2-(cyclohexylsulfanylmethyl)benzoate Openeye Name: 2-(cyclohexylsulfanylmethyl)benzoate CAS Name: 2-[(cyclohexylthio)methyl]benzoate IUPAC Name: 2-(cyclohexylsulfanylmethyl)benzoate Traditional Name: 2-[(cyclohexylthio)methyl]benzoate Formula: C14H17O2S- MolecularWeight: 249.34858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)SCC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H18O2S/c15-14(16)13-9-5-4-6-11(13)10-17-12-7-2-1-3-8-12/h4-6,9,12H,1-3,7-8,10H2,(H,15,16)/p-1