3-cyclohexyl-2-oxidanyl-5-sulfanyl-benzoic acid

Systemtic Name: 3-cyclohexyl-2-oxidanyl-5-sulfanyl-benzoic acid Openeye Name: 3-cyclohexyl-2-hydroxy-5-sulfanyl-benzoic acid CAS Name: 3-cyclohexyl-2-hydroxy-5-mercaptobenzoic acid IUPAC Name: 3-cyclohexyl-2-hydroxy-5-sulfanylbenzoic acid Traditional Name: 3-cyclohexyl-2-hydroxy-5-mercapto-benzoic acid Formula: C13H16O3S MolecularWeight: 252.32934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3S/c14-12-10(8-4-2-1-3-5-8)6-9(17)7-11(12)13(15)16/h6-8,14,17H,1-5H2,(H,15,16)