3-[(6-chloranylpyridin-3-yl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(6-chloranylpyridin-3-yl)methylsulfanyl]propanoic acid Openeye Name: 3-[(6-chloro-3-pyridyl)methylsulfanyl]propanoic acid CAS Name: 3-[(6-chloro-3-pyridinyl)methylthio]propanoic acid IUPAC Name: 3-[(6-chloropyridin-3-yl)methylsulfanyl]propanoic acid Traditional Name: 3-[(6-chloro-3-pyridyl)methylthio]propionic acid Formula: C9H10ClNO2S MolecularWeight: 231.6992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1CSCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=NC=C1CSCCC(=O)O)Cl

InChI

InChI=1S/C9H10ClNO2S/c10-8-2-1-7(5-11-8)6-14-4-3-9(12)13/h1-2,5H,3-4,6H2,(H,12,13)