(4-methoxy-2,5-dimethyl-phenyl)methyl-(3-methoxypropyl)-(pyridin-2-ylmethyl)azanium

Systemtic Name: (4-methoxy-2,5-dimethyl-phenyl)methyl-(3-methoxypropyl)-(pyridin-2-ylmethyl)azanium Openeye Name: (4-methoxy-2,5-dimethyl-phenyl)methyl-(3-methoxypropyl)-(2-pyridylmethyl)ammonium CAS Name: (4-methoxy-2,5-dimethylphenyl)methyl-(3-methoxypropyl)-(2-pyridinylmethyl)ammonium IUPAC Name: (4-methoxy-2,5-dimethylphenyl)methyl-(3-methoxypropyl)-(pyridin-2-ylmethyl)azanium Traditional Name: (4-methoxy-2,5-dimethyl-benzyl)-(3-methoxypropyl)-(2-pyridylmethyl)ammonium Formula: C20H29N2O2+ MolecularWeight: 329.45646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](CCCOC)CC2=CC=CC=N2)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](CCCOC)CC2=CC=CC=N2)C)OC

InChI

InChI=1S/C20H28N2O2/c1-16-13-20(24-4)17(2)12-18(16)14-22(10-7-11-23-3)15-19-8-5-6-9-21-19/h5-6,8-9,12-13H,7,10-11,14-15H2,1-4H3/p+1