4-[1,3-bis(phenylmethyl)imidazolidine-1,3-diium-2-yl]-N,N-dimethyl-2-nitro-aniline

Systemtic Name: 4-[1,3-bis(phenylmethyl)imidazolidine-1,3-diium-2-yl]-N,N-dimethyl-2-nitro-aniline Openeye Name: 4-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)-N,N-dimethyl-2-nitro-aniline CAS Name: 4-[1,3-bis(phenylmethyl)-2-imidazolidine-1,3-diiumyl]-N,N-dimethyl-2-nitroaniline IUPAC Name: 4-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)-N,N-dimethyl-2-nitroaniline Traditional Name: [4-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)-2-nitro-phenyl]-dimethyl-amine Formula: C25H30N4O2+2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C2[NH+](CC[NH+]2CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C2[NH+](CC[NH+]2CC3=CC=CC=C3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H28N4O2/c1-26(2)23-14-13-22(17-24(23)29(30)31)25-27(18-20-9-5-3-6-10-20)15-16-28(25)19-21-11-7-4-8-12-21/h3-14,17,25H,15-16,18-19H2,1-2H3/p+2