2-[4-(3-ethylsulfanylphenyl)phenyl]propanoic acid

Systemtic Name: 2-[4-(3-ethylsulfanylphenyl)phenyl]propanoic acid Openeye Name: 2-[4-(3-ethylsulfanylphenyl)phenyl]propanoic acid CAS Name: 2-[4-[3-(ethylthio)phenyl]phenyl]propanoic acid IUPAC Name: 2-[4-(3-ethylsulfanylphenyl)phenyl]propanoic acid Traditional Name: 2-[4-[3-(ethylthio)phenyl]phenyl]propionic acid Formula: C17H18O2S MolecularWeight: 286.38862

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C2=CC=C(C=C2)C(C)C(=O)O

Isomeric SMILES

CCSC1=CC=CC(=C1)C2=CC=C(C=C2)C(C)C(=O)O

InChI

InChI=1S/C17H18O2S/c1-3-20-16-6-4-5-15(11-16)14-9-7-13(8-10-14)12(2)17(18)19/h4-12H,3H2,1-2H3,(H,18,19)