2-pyridin-4-ylsulfanylcyclopentene-1-carboxylic acid

Systemtic Name: 2-pyridin-4-ylsulfanylcyclopentene-1-carboxylic acid Openeye Name: 2-(4-pyridylsulfanyl)cyclopentene-1-carboxylic acid CAS Name: 2-(pyridin-4-ylthio)-1-cyclopentenecarboxylic acid IUPAC Name: 2-pyridin-4-ylsulfanylcyclopentene-1-carboxylic acid Traditional Name: 2-(4-pyridylthio)cyclopentene-1-carboxylic acid Formula: C11H11NO2S MolecularWeight: 221.27554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)SC2=CC=NC=C2)C(=O)O

Isomeric SMILES

C1CC(=C(C1)SC2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C11H11NO2S/c13-11(14)9-2-1-3-10(9)15-8-4-6-12-7-5-8/h4-7H,1-3H2,(H,13,14)