N-(5-azanyl-2-fluoranyl-phenyl)-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propanamide

Systemtic Name: N-(5-azanyl-2-fluoranyl-phenyl)-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propanamide Openeye Name: N-(5-amino-2-fluoro-phenyl)-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propanamide CAS Name: N-(5-amino-2-fluorophenyl)-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propanamide IUPAC Name: N-(5-amino-2-fluorophenyl)-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propanamide Traditional Name: N-(5-amino-2-fluoro-phenyl)-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propionamide Formula: C15H24FN4O+ MolecularWeight: 295.375663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)CCC(=O)NC2=C(C=CC(=C2)N)F

Isomeric SMILES

C[NH+]1CCCN(CC1)CCC(=O)NC2=C(C=CC(=C2)N)F

InChI

InChI=1S/C15H23FN4O/c1-19-6-2-7-20(10-9-19)8-5-15(21)18-14-11-12(17)3-4-13(14)16/h3-4,11H,2,5-10,17H2,1H3,(H,18,21)/p+1