2-(5-ethyl-2-phenylsulfanyl-phenyl)ethanoic acid

Systemtic Name: 2-(5-ethyl-2-phenylsulfanyl-phenyl)ethanoic acid Openeye Name: 2-(5-ethyl-2-phenylsulfanyl-phenyl)acetic acid CAS Name: 2-[5-ethyl-2-(phenylthio)phenyl]acetic acid IUPAC Name: 2-(5-ethyl-2-phenylsulfanylphenyl)acetic acid Traditional Name: 2-[5-ethyl-2-(phenylthio)phenyl]acetic acid Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)SC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CCC1=CC(=C(C=C1)SC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C16H16O2S/c1-2-12-8-9-15(13(10-12)11-16(17)18)19-14-6-4-3-5-7-14/h3-10H,2,11H2,1H3,(H,17,18)