2-(phenylmethyl)-3-(triphenylmethyl)sulfanyl-propanoic acid

Systemtic Name: 2-(phenylmethyl)-3-(triphenylmethyl)sulfanyl-propanoic acid Openeye Name: 2-benzyl-3-tritylsulfanyl-propanoic acid CAS Name: 2-(phenylmethyl)-3-[(triphenylmethyl)thio]propanoic acid IUPAC Name: 2-benzyl-3-tritylsulfanylpropanoic acid Traditional Name: 2-benzyl-3-(tritylthio)propionic acid Formula: C29H26O2S MolecularWeight: 438.58054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C29H26O2S/c30-28(31)24(21-23-13-5-1-6-14-23)22-32-29(25-15-7-2-8-16-25,26-17-9-3-10-18-26)27-19-11-4-12-20-27/h1-20,24H,21-22H2,(H,30,31)