2-[(2-chloranylquinolin-3-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(2-chloranylquinolin-3-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-chloro-3-quinolyl)methylsulfanyl]acetic acid CAS Name: 2-[(2-chloro-3-quinolinyl)methylthio]acetic acid IUPAC Name: 2-[(2-chloroquinolin-3-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-chloro-3-quinolyl)methylthio]acetic acid Formula: C12H10ClNO2S MolecularWeight: 267.7313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSCC(=O)O

InChI

InChI=1S/C12H10ClNO2S/c13-12-9(6-17-7-11(15)16)5-8-3-1-2-4-10(8)14-12/h1-5H,6-7H2,(H,15,16)