5-(3-chloranylpropylsulfanyl)pyridine-2-carboxylate

Systemtic Name: 5-(3-chloranylpropylsulfanyl)pyridine-2-carboxylate Openeye Name: 5-(3-chloropropylsulfanyl)pyridine-2-carboxylate CAS Name: 5-(3-chloropropylthio)-2-pyridinecarboxylate IUPAC Name: 5-(3-chloropropylsulfanyl)pyridine-2-carboxylate Traditional Name: 5-(3-chloropropylthio)picolinate Formula: C9H9ClNO2S- MolecularWeight: 230.69126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1SCCCCl)C(=O)[O-]

Isomeric SMILES

C1=CC(=NC=C1SCCCCl)C(=O)[O-]

InChI

InChI=1S/C9H10ClNO2S/c10-4-1-5-14-7-2-3-8(9(12)13)11-6-7/h2-3,6H,1,4-5H2,(H,12,13)/p-1