5-methyl-2-(phenylmethyl)sulfinyl-benzoic acid

Systemtic Name: 5-methyl-2-(phenylmethyl)sulfinyl-benzoic acid Openeye Name: 2-benzylsulfinyl-5-methyl-benzoic acid CAS Name: 5-methyl-2-(phenylmethyl)sulfinylbenzoic acid IUPAC Name: 2-benzylsulfinyl-5-methylbenzoic acid Traditional Name: 2-benzylsulfinyl-5-methyl-benzoic acid Formula: C15H14O3S MolecularWeight: 274.33486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H14O3S/c1-11-7-8-14(13(9-11)15(16)17)19(18)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,16,17)