2-[2-(hydroxymethyl)-4-methoxy-phenyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-(hydroxymethyl)-4-methoxy-phenyl]sulfanylbenzoic acid Openeye Name: 2-[2-(hydroxymethyl)-4-methoxy-phenyl]sulfanylbenzoic acid CAS Name: 2-[[2-(hydroxymethyl)-4-methoxyphenyl]thio]benzoic acid IUPAC Name: 2-[2-(hydroxymethyl)-4-methoxyphenyl]sulfanylbenzoic acid Traditional Name: 2-[(4-methoxy-2-methylol-phenyl)thio]benzoic acid Formula: C15H14O4S MolecularWeight: 290.33426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)SC2=CC=CC=C2C(=O)O)CO

Isomeric SMILES

COC1=CC(=C(C=C1)SC2=CC=CC=C2C(=O)O)CO

InChI

InChI=1S/C15H14O4S/c1-19-11-6-7-13(10(8-11)9-16)20-14-5-3-2-4-12(14)15(17)18/h2-8,16H,9H2,1H3,(H,17,18)