1-[bis(4-fluorophenyl)methyl]-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium

Systemtic Name: 1-[bis(4-fluorophenyl)methyl]-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium Openeye Name: 1-[bis(4-fluorophenyl)methyl]-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium CAS Name: 1-[bis(4-fluorophenyl)methyl]-4-(5-nitro-2-pyridin-1-iumyl)piperazin-1-ium IUPAC Name: 1-[bis(4-fluorophenyl)methyl]-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium Traditional Name: 1-[bis(4-fluorophenyl)methyl]-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium Formula: C22H22F2N4O2+2 MolecularWeight: 412.432486

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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)C4=[NH+]C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H20F2N4O2/c23-18-5-1-16(2-6-18)22(17-3-7-19(24)8-4-17)27-13-11-26(12-14-27)21-10-9-20(15-25-21)28(29)30/h1-10,15,22H,11-14H2/p+2