1-(2-methylsulfanylphenyl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-(2-methylsulfanylphenyl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(2-methylsulfanylbenzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[2-(methylthio)phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-(2-methylsulfanylbenzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[2-(methylthio)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCCC3=C(C=CC=C32)C(=O)O

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCCC3=C(C=CC=C32)C(=O)O

InChI

InChI=1S/C18H17NO3S/c1-23-16-10-3-2-6-14(16)17(20)19-11-5-8-12-13(18(21)22)7-4-9-15(12)19/h2-4,6-7,9-10H,5,8,11H2,1H3,(H,21,22)