3-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylamino]propyl-dimethyl-azanium Openeye Name: 3-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylamino]propyl-dimethyl-ammonium CAS Name: 3-[(4-methoxy-3,5-dimethyl-2-pyridin-1-iumyl)methylamino]propyl-dimethylammonium IUPAC Name: 3-[(4-methoxy-3,5-dimethylpyridin-1-ium-2-yl)methylamino]propyl-dimethylazanium Traditional Name: 3-[(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylamino]propyl-dimethyl-ammonium Formula: C14H27N3O+2 MolecularWeight: 253.38368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C(=C1OC)C)CNCCC[NH+](C)C

Isomeric SMILES

CC1=C[NH+]=C(C(=C1OC)C)CNCCC[NH+](C)C

InChI

InChI=1S/C14H25N3O/c1-11-9-16-13(12(2)14(11)18-5)10-15-7-6-8-17(3)4/h9,15H,6-8,10H2,1-5H3/p+2