6-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-[(3,5-dimethyl-1-piperidyl)sulfonyl]-1-ethyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-1-ethyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-ethyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-(3,5-dimethylpiperidino)sulfonyl-1-ethyl-4-keto-quinoline-3-carboxylic acid Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CC(CC(C3)C)C)C(=O)O

InChI

InChI=1S/C19H24N2O5S/c1-4-20-11-16(19(23)24)18(22)15-8-14(5-6-17(15)20)27(25,26)21-9-12(2)7-13(3)10-21/h5-6,8,11-13H,4,7,9-10H2,1-3H3,(H,23,24)