1-methyl-4-oxidanylidene-6-piperidin-1-ylsulfonyl-quinoline-3-carboxylic acid

Systemtic Name: 1-methyl-4-oxidanylidene-6-piperidin-1-ylsulfonyl-quinoline-3-carboxylic acid Openeye Name: 1-methyl-4-oxo-6-(1-piperidylsulfonyl)quinoline-3-carboxylic acid CAS Name: 1-methyl-4-oxo-6-(1-piperidinylsulfonyl)-3-quinolinecarboxylic acid IUPAC Name: 1-methyl-4-oxo-6-piperidin-1-ylsulfonylquinoline-3-carboxylic acid Traditional Name: 4-keto-1-methyl-6-piperidinosulfonyl-quinoline-3-carboxylic acid Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)O

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCCCC3)C(=O)O

InChI

InChI=1S/C16H18N2O5S/c1-17-10-13(16(20)21)15(19)12-9-11(5-6-14(12)17)24(22,23)18-7-3-2-4-8-18/h5-6,9-10H,2-4,7-8H2,1H3,(H,20,21)