2-[2-(2-phenylpyrrol-1-yl)ethylsulfanyl]ethanoic acid

Systemtic Name: 2-[2-(2-phenylpyrrol-1-yl)ethylsulfanyl]ethanoic acid Openeye Name: 2-[2-(2-phenylpyrrol-1-yl)ethylsulfanyl]acetic acid CAS Name: 2-[2-(2-phenyl-1-pyrrolyl)ethylthio]acetic acid IUPAC Name: 2-[2-(2-phenylpyrrol-1-yl)ethylsulfanyl]acetic acid Traditional Name: 2-[2-(2-phenylpyrrol-1-yl)ethylthio]acetic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CN2CCSCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CN2CCSCC(=O)O

InChI

InChI=1S/C14H15NO2S/c16-14(17)11-18-10-9-15-8-4-7-13(15)12-5-2-1-3-6-12/h1-8H,9-11H2,(H,16,17)