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

Systemtic Name: diethyl-[2-[(2-oxidanyl-4-oxidanylidene-1-propyl-quinolin-3-yl)carbonylamino]ethyl]-prop-2-enyl-azanium iodide Openeye Name: allyl-diethyl-[2-[(2-hydroxy-4-oxo-1-propyl-quinoline-3-carbonyl)amino]ethyl]ammonium iodide CAS Name: diethyl-[2-[[(2-hydroxy-4-oxo-1-propyl-3-quinolinyl)-oxomethyl]amino]ethyl]-prop-2-enylammonium iodide IUPAC Name: diethyl-[2-[(2-hydroxy-4-oxo-1-propylquinoline-3-carbonyl)amino]ethyl]-prop-2-enylazanium iodide Traditional Name: allyl-diethyl-[2-[(2-hydroxy-4-keto-1-propyl-quinoline-3-carbonyl)amino]ethyl]ammonium iodide Formula: C22H32IN3O3 MolecularWeight: 513.41225

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NCC[N+](CC)(CC)CC=C.[I-]

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NCC[N+](CC)(CC)CC=C.[I-]

InChI

InChI=1S/C22H31N3O3.HI/c1-5-14-24-18-12-10-9-11-17(18)20(26)19(22(24)28)21(27)23-13-16-25(7-3,8-4)15-6-2;/h6,9-12H,2,5,7-8,13-16H2,1,3-4H3,(H-,23,26,27,28);1H