(3-methoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium

Systemtic Name: (3-methoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium Openeye Name: (3-methoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(4-pyridylmethyl)ammonium CAS Name: (3-methoxyphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: (3-methoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)-(pyridin-4-ylmethyl)azanium Traditional Name: m-anisyl-(3-morpholin-4-ium-4-ylpropyl)-(4-pyridylmethyl)ammonium Formula: C21H31N3O2+2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+](CCC[NH+]2CCOCC2)CC3=CC=NC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+](CCC[NH+]2CCOCC2)CC3=CC=NC=C3

InChI

InChI=1S/C21H29N3O2/c1-25-21-5-2-4-20(16-21)18-24(17-19-6-8-22-9-7-19)11-3-10-23-12-14-26-15-13-23/h2,4-9,16H,3,10-15,17-18H2,1H3/p+2