(phenylmethyl)-[[2-(pyridin-2-ylmethoxy)phenyl]methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: (phenylmethyl)-[[2-(pyridin-2-ylmethoxy)phenyl]methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: benzyl-[[2-(2-pyridylmethoxy)phenyl]methyl]-(4-pyridylmethyl)ammonium CAS Name: (phenylmethyl)-[[2-(2-pyridinylmethoxy)phenyl]methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: benzyl-[[2-(pyridin-2-ylmethoxy)phenyl]methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: benzyl-[2-(2-pyridylmethoxy)benzyl]-(4-pyridylmethyl)ammonium Formula: C26H26N3O+ MolecularWeight: 396.50414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CC=CC=C3OCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CC=CC=C3OCC4=CC=CC=N4

InChI

InChI=1S/C26H25N3O/c1-2-8-22(9-3-1)18-29(19-23-13-16-27-17-14-23)20-24-10-4-5-12-26(24)30-21-25-11-6-7-15-28-25/h1-17H,18-21H2/p+1