4,4,4-triphenyl-2-sulfanyl-butanoic acid

Systemtic Name: 4,4,4-triphenyl-2-sulfanyl-butanoic acid Openeye Name: 4,4,4-triphenyl-2-sulfanyl-butanoic acid CAS Name: 2-mercapto-4,4,4-triphenylbutanoic acid IUPAC Name: 4,4,4-triphenyl-2-sulfanylbutanoic acid Traditional Name: 2-mercapto-4,4,4-triphenyl-butyric acid Formula: C22H20O2S MolecularWeight: 348.458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(C(=O)O)S)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CC(C(=O)O)S)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H20O2S/c23-21(24)20(25)16-22(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20,25H,16H2,(H,23,24)