butyl-diethyl-[2-[(2-oxidanyl-4-oxidanylidene-1-propyl-quinolin-3-yl)carbonylamino]ethyl]azanium iodide

Systemtic Name: butyl-diethyl-[2-[(2-oxidanyl-4-oxidanylidene-1-propyl-quinolin-3-yl)carbonylamino]ethyl]azanium iodide Openeye Name: butyl-diethyl-[2-[(2-hydroxy-4-oxo-1-propyl-quinoline-3-carbonyl)amino]ethyl]ammonium iodide CAS Name: butyl-diethyl-[2-[[(2-hydroxy-4-oxo-1-propyl-3-quinolinyl)-oxomethyl]amino]ethyl]ammonium iodide IUPAC Name: butyl-diethyl-[2-[(2-hydroxy-4-oxo-1-propylquinoline-3-carbonyl)amino]ethyl]azanium iodide Traditional Name: butyl-diethyl-[2-[(2-hydroxy-4-keto-1-propyl-quinoline-3-carbonyl)amino]ethyl]ammonium iodide Formula: C23H36IN3O3 MolecularWeight: 529.45471

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CC)(CC)CCNC(=O)C1=C(N(C2=CC=CC=C2C1=O)CCC)O.[I-]

Isomeric SMILES

CCCC[N+](CC)(CC)CCNC(=O)C1=C(N(C2=CC=CC=C2C1=O)CCC)O.[I-]

InChI

InChI=1S/C23H35N3O3.HI/c1-5-9-16-26(7-3,8-4)17-14-24-22(28)20-21(27)18-12-10-11-13-19(18)25(15-6-2)23(20)29;/h10-13H,5-9,14-17H2,1-4H3,(H-,24,27,28,29);1H