3-cyclohexyl-8-fluoranyl-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one

Systemtic Name: 3-cyclohexyl-8-fluoranyl-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Openeye Name: 3-cyclohexyl-8-fluoro-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one CAS Name: 3-cyclohexyl-8-fluoro-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one IUPAC Name: 3-cyclohexyl-8-fluoro-1,5-dihydropyrimido[5,4-b]indol-3-ium-4-one Traditional Name: 3-cyclohexyl-8-fluoro-1,5-dihydropyrimid[5,4-b]indol-3-ium-4-one Formula: C16H17FN3O+ MolecularWeight: 286.324083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[N+]2=CNC3=C(C2=O)NC4=C3C=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)[N+]2=CNC3=C(C2=O)NC4=C3C=C(C=C4)F

InChI

InChI=1S/C16H16FN3O/c17-10-6-7-13-12(8-10)14-15(19-13)16(21)20(9-18-14)11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,19,21)/p+1