4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-3-nitro-benzamide Openeye Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-3-nitro-benzamide CAS Name: 4-[[4-[bis(4-fluorophenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]-3-nitrobenzamide IUPAC Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-3-nitrobenzamide Traditional Name: 4-[[4-[bis(4-fluorophenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-3-nitro-benzamide Formula: C25H26F2N4O3+2 MolecularWeight: 468.495746

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H24F2N4O3/c26-21-7-3-17(4-8-21)24(18-5-9-22(27)10-6-18)30-13-11-29(12-14-30)16-20-2-1-19(25(28)32)15-23(20)31(33)34/h1-10,15,24H,11-14,16H2,(H2,28,32)/p+2