N-(5-azanyl-2-fluoranyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propanamide

Systemtic Name: N-(5-azanyl-2-fluoranyl-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propanamide Openeye Name: N-(5-amino-2-fluoro-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propanamide CAS Name: N-(5-amino-2-fluorophenyl)-3-(4-methyl-1-piperazin-4-iumyl)propanamide IUPAC Name: N-(5-amino-2-fluorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)propanamide Traditional Name: N-(5-amino-2-fluoro-phenyl)-3-(4-methylpiperazin-4-ium-1-yl)propionamide Formula: C14H22FN4O+ MolecularWeight: 281.349083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21FN4O/c1-18-6-8-19(9-7-18)5-4-14(20)17-13-10-11(16)2-3-12(13)15/h2-3,10H,4-9,16H2,1H3,(H,17,20)/p+1