(2S)-2-[4-(4-tert-butylphenyl)phenyl]sulfanylpropanoic acid

Systemtic Name: (2S)-2-[4-(4-tert-butylphenyl)phenyl]sulfanylpropanoic acid Openeye Name: (2S)-2-[4-(4-tert-butylphenyl)phenyl]sulfanylpropanoic acid CAS Name: (2S)-2-[[4-(4-tert-butylphenyl)phenyl]thio]propanoic acid IUPAC Name: (2S)-2-[4-(4-tert-butylphenyl)phenyl]sulfanylpropanoic acid Traditional Name: (2S)-2-[[4-(4-tert-butylphenyl)phenyl]thio]propionic acid Formula: C19H22O2S MolecularWeight: 314.44178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)O)SC1=CC=C(C=C1)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C19H22O2S/c1-13(18(20)21)22-17-11-7-15(8-12-17)14-5-9-16(10-6-14)19(2,3)4/h5-13H,1-4H3,(H,20,21)/t13-/m0/s1