2-[(2-methoxyphenyl)methylsulfanyl]-4-phenyl-benzoic acid

Systemtic Name: 2-[(2-methoxyphenyl)methylsulfanyl]-4-phenyl-benzoic acid Openeye Name: 2-[(2-methoxyphenyl)methylsulfanyl]-4-phenyl-benzoic acid CAS Name: 2-[(2-methoxyphenyl)methylthio]-4-phenylbenzoic acid IUPAC Name: 2-[(2-methoxyphenyl)methylsulfanyl]-4-phenylbenzoic acid Traditional Name: 2-(o-anisylthio)-4-phenyl-benzoic acid Formula: C21H18O3S MolecularWeight: 350.43082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CSC2=C(C=CC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=CC=C1CSC2=C(C=CC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H18O3S/c1-24-19-10-6-5-9-17(19)14-25-20-13-16(11-12-18(20)21(22)23)15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H,22,23)