3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoic acid

Systemtic Name: 3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoic acid Openeye Name: 3-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanoic acid CAS Name: 3-[(4,8-dimethyl-2-quinolinyl)thio]propanoic acid IUPAC Name: 3-(4,8-dimethylquinolin-2-yl)sulfanylpropanoic acid Traditional Name: 3-[(4,8-dimethyl-2-quinolyl)thio]propionic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)O

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)O

InChI

InChI=1S/C14H15NO2S/c1-9-4-3-5-11-10(2)8-12(15-14(9)11)18-7-6-13(16)17/h3-5,8H,6-7H2,1-2H3,(H,16,17)