4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-nitro-benzamide Openeye Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-nitro-benzamide CAS Name: 4-[4-[bis(4-fluorophenyl)methyl]-1-piperazin-4-iumyl]-3-nitrobenzamide IUPAC Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-[bis(4-fluorophenyl)methyl]piperazin-4-ium-1-yl]-3-nitro-benzamide 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)C4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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