3-(4-phenylmethoxyphenyl)-2-(triphenylmethyl)sulfanyl-propanoic acid

Systemtic Name: 3-(4-phenylmethoxyphenyl)-2-(triphenylmethyl)sulfanyl-propanoic acid Openeye Name: 3-(4-benzyloxyphenyl)-2-tritylsulfanyl-propanoic acid CAS Name: 3-(4-phenylmethoxyphenyl)-2-[(triphenylmethyl)thio]propanoic acid IUPAC Name: 3-(4-phenylmethoxyphenyl)-2-tritylsulfanylpropanoic acid Traditional Name: 3-(4-benzoxyphenyl)-2-(tritylthio)propionic acid Formula: C35H30O3S MolecularWeight: 530.6759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C35H30O3S/c36-34(37)33(25-27-21-23-32(24-22-27)38-26-28-13-5-1-6-14-28)39-35(29-15-7-2-8-16-29,30-17-9-3-10-18-30)31-19-11-4-12-20-31/h1-24,33H,25-26H2,(H,36,37)