4-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)propyl]benzoic acid

Systemtic Name: 4-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)propyl]benzoic acid Openeye Name: 4-[3-(2-benzyloxy-5-methylsulfanyl-phenyl)propyl]benzoic acid CAS Name: 4-[3-[5-(methylthio)-2-phenylmethoxyphenyl]propyl]benzoic acid IUPAC Name: 4-[3-(5-methylsulfanyl-2-phenylmethoxyphenyl)propyl]benzoic acid Traditional Name: 4-[3-[2-benzoxy-5-(methylthio)phenyl]propyl]benzoic acid Formula: C24H24O3S MolecularWeight: 392.51056

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H24O3S/c1-28-22-14-15-23(27-17-19-6-3-2-4-7-19)21(16-22)9-5-8-18-10-12-20(13-11-18)24(25)26/h2-4,6-7,10-16H,5,8-9,17H2,1H3,(H,25,26)