N-[3-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[3-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[3-fluoro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C18H29FN4O+2 MolecularWeight: 336.447463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C[NH+]3CCCCC3)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C[NH+]3CCCCC3)F

InChI

InChI=1S/C18H27FN4O/c1-21-9-11-23(12-10-21)17-6-5-15(13-16(17)19)20-18(24)14-22-7-3-2-4-8-22/h5-6,13H,2-4,7-12,14H2,1H3,(H,20,24)/p+2