4-(4-methoxyphenyl)-2-(sulfanylmethyl)butanoic acid

Systemtic Name: 4-(4-methoxyphenyl)-2-(sulfanylmethyl)butanoic acid Openeye Name: 4-(4-methoxyphenyl)-2-(sulfanylmethyl)butanoic acid CAS Name: 2-(mercaptomethyl)-4-(4-methoxyphenyl)butanoic acid IUPAC Name: 4-(4-methoxyphenyl)-2-(sulfanylmethyl)butanoic acid Traditional Name: 2-(mercaptomethyl)-4-(4-methoxyphenyl)butyric acid Formula: C12H16O3S MolecularWeight: 240.31864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(CS)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCC(CS)C(=O)O

InChI

InChI=1S/C12H16O3S/c1-15-11-6-3-9(4-7-11)2-5-10(8-16)12(13)14/h3-4,6-7,10,16H,2,5,8H2,1H3,(H,13,14)