5-methyl-2-(phenylmethylsulfanyl)benzoic acid

Systemtic Name: 5-methyl-2-(phenylmethylsulfanyl)benzoic acid Openeye Name: 2-benzylsulfanyl-5-methyl-benzoic acid CAS Name: 5-methyl-2-(phenylmethylthio)benzoic acid IUPAC Name: 2-benzylsulfanyl-5-methylbenzoic acid Traditional Name: 2-(benzylthio)-5-methyl-benzoic acid Formula: C15H14O2S MolecularWeight: 258.33546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H14O2S/c1-11-7-8-14(13(9-11)15(16)17)18-10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17)