3-(4-methoxyphenyl)-2-[2-(3-methylphenoxy)phenyl]sulfanyl-2-oxidanyl-propanoic acid

Systemtic Name: 3-(4-methoxyphenyl)-2-[2-(3-methylphenoxy)phenyl]sulfanyl-2-oxidanyl-propanoic acid Openeye Name: 2-hydroxy-3-(4-methoxyphenyl)-2-[2-(3-methylphenoxy)phenyl]sulfanyl-propanoic acid CAS Name: 2-hydroxy-3-(4-methoxyphenyl)-2-[[2-(3-methylphenoxy)phenyl]thio]propanoic acid IUPAC Name: 2-hydroxy-3-(4-methoxyphenyl)-2-[2-(3-methylphenoxy)phenyl]sulfanylpropanoic acid Traditional Name: 2-hydroxy-3-(4-methoxyphenyl)-2-[[2-(3-methylphenoxy)phenyl]thio]propionic acid Formula: C23H22O5S MolecularWeight: 410.48278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=CC=C2SC(CC3=CC=C(C=C3)OC)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=CC=C2SC(CC3=CC=C(C=C3)OC)(C(=O)O)O

InChI

InChI=1S/C23H22O5S/c1-16-6-5-7-19(14-16)28-20-8-3-4-9-21(20)29-23(26,22(24)25)15-17-10-12-18(27-2)13-11-17/h3-14,26H,15H2,1-2H3,(H,24,25)