(4-ethoxy-3-methoxy-phenyl)methyl-(pyridin-3-ylmethyl)-(pyridin-4-ylmethyl)azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-(pyridin-3-ylmethyl)-(pyridin-4-ylmethyl)azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-(3-pyridylmethyl)-(4-pyridylmethyl)ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-(3-pyridinylmethyl)-(pyridin-4-ylmethyl)ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-(pyridin-3-ylmethyl)-(pyridin-4-ylmethyl)azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-(3-pyridylmethyl)-(4-pyridylmethyl)ammonium Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CN=CC=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](CC2=CC=NC=C2)CC3=CN=CC=C3)OC

InChI

InChI=1S/C22H25N3O2/c1-3-27-21-7-6-19(13-22(21)26-2)16-25(15-18-8-11-23-12-9-18)17-20-5-4-10-24-14-20/h4-14H,3,15-17H2,1-2H3/p+1