8-fluoranyl-N-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine

Systemtic Name: 8-fluoranyl-N-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine Openeye Name: 8-fluoro-N-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine CAS Name: 8-fluoro-N-[2-(1-piperidin-1-iumyl)ethyl]-5H-pyrimido[5,4-b]indol-4-amine IUPAC Name: 8-fluoro-N-(2-piperidin-1-ium-1-ylethyl)-5H-pyrimido[5,4-b]indol-4-amine Traditional Name: (8-fluoro-5H-pyrimid[5,4-b]indol-4-yl)-(2-piperidin-1-ium-1-ylethyl)amine Formula: C17H21FN5+ MolecularWeight: 314.380543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC2=NC=NC3=C2NC4=C3C=C(C=C4)F

Isomeric SMILES

C1CC[NH+](CC1)CCNC2=NC=NC3=C2NC4=C3C=C(C=C4)F

InChI

InChI=1S/C17H20FN5/c18-12-4-5-14-13(10-12)15-16(22-14)17(21-11-20-15)19-6-9-23-7-2-1-3-8-23/h4-5,10-11,22H,1-3,6-9H2,(H,19,20,21)/p+1