N-[2-azanyl-5-(1-ethanoylpiperazin-1-ium-1-yl)-4-fluoranyl-phenyl]-N-cyclopropyl-ethanamide

Systemtic Name: N-[2-azanyl-5-(1-ethanoylpiperazin-1-ium-1-yl)-4-fluoranyl-phenyl]-N-cyclopropyl-ethanamide Openeye Name: N-[5-(1-acetylpiperazin-1-ium-1-yl)-2-amino-4-fluoro-phenyl]-N-cyclopropyl-acetamide CAS Name: N-[5-(1-acetyl-1-piperazin-1-iumyl)-2-amino-4-fluorophenyl]-N-cyclopropylacetamide IUPAC Name: N-[5-(1-acetylpiperazin-1-ium-1-yl)-2-amino-4-fluorophenyl]-N-cyclopropylacetamide Traditional Name: N-[5-(1-acetylpiperazin-1-ium-1-yl)-2-amino-4-fluoro-phenyl]-N-cyclopropyl-acetamide Formula: C17H24FN4O2+ MolecularWeight: 335.396463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1CC1)C2=CC(=C(C=C2N)F)[N+]3(CCNCC3)C(=O)C

Isomeric SMILES

CC(=O)N(C1CC1)C2=CC(=C(C=C2N)F)[N+]3(CCNCC3)C(=O)C

InChI

InChI=1S/C17H24FN4O2/c1-11(23)21(13-3-4-13)16-10-17(14(18)9-15(16)19)22(12(2)24)7-5-20-6-8-22/h9-10,13,20H,3-8,19H2,1-2H3/q+1