4-(2-cyclohexylethylsulfanyl)benzoic acid

Systemtic Name: 4-(2-cyclohexylethylsulfanyl)benzoic acid Openeye Name: 4-(2-cyclohexylethylsulfanyl)benzoic acid CAS Name: 4-(2-cyclohexylethylthio)benzoic acid IUPAC Name: 4-(2-cyclohexylethylsulfanyl)benzoic acid Traditional Name: 4-(2-cyclohexylethylthio)benzoic acid Formula: C15H20O2S MolecularWeight: 264.3831

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)CCSC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H20O2S/c16-15(17)13-6-8-14(9-7-13)18-11-10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,16,17)