[1-(2-chloranylprop-2-enyl)-7-fluoranyl-2-oxidanylidene-quinolin-3-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [1-(2-chloranylprop-2-enyl)-7-fluoranyl-2-oxidanylidene-quinolin-3-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [1-(2-chloroallyl)-7-fluoro-2-oxo-3-quinolyl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [1-(2-chloroprop-2-enyl)-7-fluoro-2-oxo-3-quinolinyl]methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [1-(2-chloroprop-2-enyl)-7-fluoro-2-oxoquinolin-3-yl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [1-(2-chloroallyl)-7-fluoro-2-keto-3-quinolyl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C20H27ClFN3O2+2 MolecularWeight: 395.898683

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1C2=C(C=CC(=C2)F)C=C(C1=O)C[NH2+]CCC[NH+]3CCOCC3)Cl

Isomeric SMILES

C=C(CN1C2=C(C=CC(=C2)F)C=C(C1=O)C[NH2+]CCC[NH+]3CCOCC3)Cl

InChI

InChI=1S/C20H25ClFN3O2/c1-15(21)14-25-19-12-18(22)4-3-16(19)11-17(20(25)26)13-23-5-2-6-24-7-9-27-10-8-24/h3-4,11-12,23H,1-2,5-10,13-14H2/p+2