2-[4,6-diphenyl-1-(pyridin-3-ylmethyl)pyridin-1-ium-2-yl]aniline perchlorate

Systemtic Name: 2-[4,6-diphenyl-1-(pyridin-3-ylmethyl)pyridin-1-ium-2-yl]aniline perchlorate Openeye Name: 2-[4,6-diphenyl-1-(3-pyridylmethyl)pyridin-1-ium-2-yl]aniline perchlorate CAS Name: 2-[4,6-diphenyl-1-(3-pyridinylmethyl)-2-pyridin-1-iumyl]aniline perchlorate IUPAC Name: 2-[4,6-diphenyl-1-(pyridin-3-ylmethyl)pyridin-1-ium-2-yl]aniline perchlorate Traditional Name: [2-[4,6-diphenyl-1-(3-pyridylmethyl)pyridin-1-ium-2-yl]phenyl]amine perchlorate Formula: C29H24ClN3O4 MolecularWeight: 513.97156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3N)CC4=CN=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3N)CC4=CN=CC=C4)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C29H23N3.ClHO4/c30-27-16-8-7-15-26(27)29-19-25(23-11-3-1-4-12-23)18-28(24-13-5-2-6-14-24)32(29)21-22-10-9-17-31-20-22;2-1(3,4)5/h1-20,30H,21H2;(H,2,3,4,5)