2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-4-phenyl-6-(trifluoromethyl)pyrimidine

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-4-phenyl-6-(trifluoromethyl)pyrimidine Openeye Name: 2-(4-benzhydrylpiperazin-4-ium-1-yl)-4-phenyl-6-(trifluoromethyl)pyrimidine CAS Name: 2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-4-phenyl-6-(trifluoromethyl)pyrimidine IUPAC Name: 2-(4-benzhydrylpiperazin-4-ium-1-yl)-4-phenyl-6-(trifluoromethyl)pyrimidine Traditional Name: 2-(4-benzhydrylpiperazin-4-ium-1-yl)-4-phenyl-6-(trifluoromethyl)pyrimidine Formula: C28H26F3N4+ MolecularWeight: 475.52805

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=CC(=N4)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=CC(=N4)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C28H25F3N4/c29-28(30,31)25-20-24(21-10-4-1-5-11-21)32-27(33-25)35-18-16-34(17-19-35)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,20,26H,16-19H2/p+1