3-[4-(4-phenylmethoxyphenyl)sulfanylphenyl]propanoic acid

Systemtic Name: 3-[4-(4-phenylmethoxyphenyl)sulfanylphenyl]propanoic acid Openeye Name: 3-[4-(4-benzyloxyphenyl)sulfanylphenyl]propanoic acid CAS Name: 3-[4-[(4-phenylmethoxyphenyl)thio]phenyl]propanoic acid IUPAC Name: 3-[4-(4-phenylmethoxyphenyl)sulfanylphenyl]propanoic acid Traditional Name: 3-[4-[(4-benzoxyphenyl)thio]phenyl]propionic acid Formula: C22H20O3S MolecularWeight: 364.4574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)SC3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)SC3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C22H20O3S/c23-22(24)15-8-17-6-11-20(12-7-17)26-21-13-9-19(10-14-21)25-16-18-4-2-1-3-5-18/h1-7,9-14H,8,15-16H2,(H,23,24)