8-fluoranyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one

Systemtic Name: 8-fluoranyl-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Openeye Name: 8-fluoro-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one CAS Name: 8-fluoro-3-[2-(4-morpholin-4-iumyl)ethyl]-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one IUPAC Name: 8-fluoro-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Traditional Name: 8-fluoro-3-(2-morpholin-4-ium-4-ylethyl)-1,5-dihydropyrimid[5,4-b]indol-3-ium-4-one Formula: C16H19FN4O2+2 MolecularWeight: 318.346063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17FN4O2/c17-11-1-2-13-12(9-11)14-15(19-13)16(22)21(10-18-14)4-3-20-5-7-23-8-6-20/h1-2,9-10H,3-8H2,(H,19,22)/p+2