1-(2-methylsulfanylethanoyl)-3,4-dihydro-2H-quinoline-6-carboxylic acid

Systemtic Name: 1-(2-methylsulfanylethanoyl)-3,4-dihydro-2H-quinoline-6-carboxylic acid Openeye Name: 1-(2-methylsulfanylacetyl)-3,4-dihydro-2H-quinoline-6-carboxylic acid CAS Name: 1-[2-(methylthio)-1-oxoethyl]-3,4-dihydro-2H-quinoline-6-carboxylic acid IUPAC Name: 1-(2-methylsulfanylacetyl)-3,4-dihydro-2H-quinoline-6-carboxylic acid Traditional Name: 1-[2-(methylthio)acetyl]-3,4-dihydro-2H-quinoline-6-carboxylic acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)N1CCCC2=C1C=CC(=C2)C(=O)O

Isomeric SMILES

CSCC(=O)N1CCCC2=C1C=CC(=C2)C(=O)O

InChI

InChI=1S/C13H15NO3S/c1-18-8-12(15)14-6-2-3-9-7-10(13(16)17)4-5-11(9)14/h4-5,7H,2-3,6,8H2,1H3,(H,16,17)