2-(6,7-dimethoxy-3-methyl-quinolin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(6,7-dimethoxy-3-methyl-quinolin-2-yl)sulfanylethanoic acid Openeye Name: 2-[(6,7-dimethoxy-3-methyl-2-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(6,7-dimethoxy-3-methyl-2-quinolinyl)thio]acetic acid IUPAC Name: 2-(6,7-dimethoxy-3-methylquinolin-2-yl)sulfanylacetic acid Traditional Name: 2-[(6,7-dimethoxy-3-methyl-2-quinolyl)thio]acetic acid Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC(=O)O

Isomeric SMILES

CC1=C(N=C2C=C(C(=CC2=C1)OC)OC)SCC(=O)O

InChI

InChI=1S/C14H15NO4S/c1-8-4-9-5-11(18-2)12(19-3)6-10(9)15-14(8)20-7-13(16)17/h4-6H,7H2,1-3H3,(H,16,17)