5-(2-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-triazin-3-amine

Systemtic Name: 5-(2-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-triazin-3-amine Openeye Name: 5-(2-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-triazin-3-amine CAS Name: 5-(2-fluorophenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(2-fluorophenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-triazin-3-amine Traditional Name: [5-(2-fluorophenyl)-1,2,4-triazin-3-yl]-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C16H21FN5O+ MolecularWeight: 318.369243

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=NC(=CN=N2)C3=CC=CC=C3F

Isomeric SMILES

C1COCC[NH+]1CCCNC2=NC(=CN=N2)C3=CC=CC=C3F

InChI

InChI=1S/C16H20FN5O/c17-14-5-2-1-4-13(14)15-12-19-21-16(20-15)18-6-3-7-22-8-10-23-11-9-22/h1-2,4-5,12H,3,6-11H2,(H,18,20,21)/p+1