4-[1,3-bis(phenylmethyl)imidazolidine-1,3-diium-2-yl]benzenecarbonitrile

Systemtic Name: 4-[1,3-bis(phenylmethyl)imidazolidine-1,3-diium-2-yl]benzenecarbonitrile Openeye Name: 4-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)benzonitrile CAS Name: 4-[1,3-bis(phenylmethyl)-2-imidazolidine-1,3-diiumyl]benzonitrile IUPAC Name: 4-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)benzonitrile Traditional Name: 4-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)benzonitrile Formula: C24H25N3+2 MolecularWeight: 355.4754

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C([NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C([NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C24H23N3/c25-17-20-11-13-23(14-12-20)24-26(18-21-7-3-1-4-8-21)15-16-27(24)19-22-9-5-2-6-10-22/h1-14,24H,15-16,18-19H2/p+2