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

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-N-[3-fluoranyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-N-[3-fluoro-4-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-[3-fluoro-4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C30H38FN5O+2 MolecularWeight: 503.654023

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)F

InChI

InChI=1S/C30H36FN5O/c1-33-14-18-35(19-15-33)28-13-12-26(22-27(28)31)32-29(37)23-34-16-20-36(21-17-34)30(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-13,22,30H,14-21,23H2,1H3,(H,32,37)/p+2