4-[bis(4-fluorophenyl)methyl]-N-(3-nitrophenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-(3-nitrophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-(3-nitrophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-(3-nitrophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-(3-nitrophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-(3-nitrophenyl)piperazin-4-ium-1-carboxamide Formula: C24H23F2N4O3+ MolecularWeight: 453.461226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H22F2N4O3/c25-19-8-4-17(5-9-19)23(18-6-10-20(26)11-7-18)28-12-14-29(15-13-28)24(31)27-21-2-1-3-22(16-21)30(32)33/h1-11,16,23H,12-15H2,(H,27,31)/p+1