6-[(2R)-2-ethylpiperidin-1-yl]sulfonyl-2-oxidanylidene-1H-quinoline-4-carboxylic acid

Systemtic Name: 6-[(2R)-2-ethylpiperidin-1-yl]sulfonyl-2-oxidanylidene-1H-quinoline-4-carboxylic acid Openeye Name: 6-[[(2R)-2-ethyl-1-piperidyl]sulfonyl]-2-oxo-1H-quinoline-4-carboxylic acid CAS Name: 6-[[(2R)-2-ethyl-1-piperidinyl]sulfonyl]-2-oxo-1H-quinoline-4-carboxylic acid IUPAC Name: 6-[(2R)-2-ethylpiperidin-1-yl]sulfonyl-2-oxo-1H-quinoline-4-carboxylic acid Traditional Name: 6-[(2R)-2-ethylpiperidino]sulfonyl-2-keto-1H-quinoline-4-carboxylic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)O

Isomeric SMILES

CC[C@@H]1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)O

InChI

InChI=1S/C17H20N2O5S/c1-2-11-5-3-4-8-19(11)25(23,24)12-6-7-15-13(9-12)14(17(21)22)10-16(20)18-15/h6-7,9-11H,2-5,8H2,1H3,(H,18,20)(H,21,22)/t11-/m1/s1