2-(2-phenylsulfanylpyrrol-1-yl)ethanoic acid

Systemtic Name: 2-(2-phenylsulfanylpyrrol-1-yl)ethanoic acid Openeye Name: 2-(2-phenylsulfanylpyrrol-1-yl)acetic acid CAS Name: 2-[2-(phenylthio)-1-pyrrolyl]acetic acid IUPAC Name: 2-(2-phenylsulfanylpyrrol-1-yl)acetic acid Traditional Name: 2-[2-(phenylthio)pyrrol-1-yl]acetic acid Formula: C12H11NO2S MolecularWeight: 233.28624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CN2CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CN2CC(=O)O

InChI

InChI=1S/C12H11NO2S/c14-12(15)9-13-8-4-7-11(13)16-10-5-2-1-3-6-10/h1-8H,9H2,(H,14,15)