8-fluoranyl-3-(3-morpholin-4-ium-4-ylpropyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one

Systemtic Name: 8-fluoranyl-3-(3-morpholin-4-ium-4-ylpropyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Openeye Name: 8-fluoro-3-(3-morpholin-4-ium-4-ylpropyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one CAS Name: 8-fluoro-3-[3-(4-morpholin-4-iumyl)propyl]-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one IUPAC Name: 8-fluoro-3-(3-morpholin-4-ium-4-ylpropyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Traditional Name: 8-fluoro-3-(3-morpholin-4-ium-4-ylpropyl)-1,5-dihydropyrimid[5,4-b]indol-3-ium-4-one Formula: C17H21FN4O2+2 MolecularWeight: 332.372643

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC[N+]2=CNC3=C(C2=O)NC4=C3C=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1CCC[N+]2=CNC3=C(C2=O)NC4=C3C=C(C=C4)F

InChI

InChI=1S/C17H19FN4O2/c18-12-2-3-14-13(10-12)15-16(20-14)17(23)22(11-19-15)5-1-4-21-6-8-24-9-7-21/h2-3,10-11H,1,4-9H2,(H,20,23)/p+2