2-[(2-chloranyl-7-methyl-quinolin-3-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(2-chloranyl-7-methyl-quinolin-3-yl)methylsulfanyl]propanoic acid Openeye Name: 2-[(2-chloro-7-methyl-3-quinolyl)methylsulfanyl]propanoic acid CAS Name: 2-[(2-chloro-7-methyl-3-quinolinyl)methylthio]propanoic acid IUPAC Name: 2-[(2-chloro-7-methylquinolin-3-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(2-chloro-7-methyl-3-quinolyl)methylthio]propionic acid Formula: C14H14ClNO2S MolecularWeight: 295.78446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)CSC(C)C(=O)O)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)CSC(C)C(=O)O)Cl

InChI

InChI=1S/C14H14ClNO2S/c1-8-3-4-10-6-11(7-19-9(2)14(17)18)13(15)16-12(10)5-8/h3-6,9H,7H2,1-2H3,(H,17,18)