2-(3,4-dimethoxyphenyl)-2-phenylsulfanyl-ethanoic acid

Systemtic Name: 2-(3,4-dimethoxyphenyl)-2-phenylsulfanyl-ethanoic acid Openeye Name: 2-(3,4-dimethoxyphenyl)-2-phenylsulfanyl-acetic acid CAS Name: 2-(3,4-dimethoxyphenyl)-2-(phenylthio)acetic acid IUPAC Name: 2-(3,4-dimethoxyphenyl)-2-phenylsulfanylacetic acid Traditional Name: 2-(3,4-dimethoxyphenyl)-2-(phenylthio)acetic acid Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)O)SC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)O)SC2=CC=CC=C2)OC

InChI

InChI=1S/C16H16O4S/c1-19-13-9-8-11(10-14(13)20-2)15(16(17)18)21-12-6-4-3-5-7-12/h3-10,15H,1-2H3,(H,17,18)