N,N-dimethylpyridin-1-ium-4-amine; 4-methoxypyridin-1-ium; pyridin-1-ium-3-carboxamide

Systemtic Name: N,N-dimethylpyridin-1-ium-4-amine; 4-methoxypyridin-1-ium; pyridin-1-ium-3-carboxamide Openeye Name: N,N-dimethylpyridin-1-ium-4-amine; 4-methoxypyridin-1-ium; pyridin-1-ium-3-carboxamide CAS Name: N,N-dimethyl-4-pyridin-1-iumamine; 4-methoxypyridin-1-ium; 3-pyridin-1-iumcarboxamide IUPAC Name: N,N-dimethylpyridin-1-ium-4-amine; 4-methoxypyridin-1-ium; pyridin-1-ium-3-carboxamide Traditional Name: dimethyl(pyridin-1-ium-4-yl)amine; 4-methoxypyridin-1-ium; pyridin-1-ium-3-carboxamide Formula: C19H26N5O2+3 MolecularWeight: 356.44204

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[NH+]C=C1.COC1=CC=[NH+]C=C1.C1=CC(=C[NH+]=C1)C(=O)N

Isomeric SMILES

CN(C)C1=CC=[NH+]C=C1.COC1=CC=[NH+]C=C1.C1=CC(=C[NH+]=C1)C(=O)N

InChI

InChI=1S/C7H10N2.C6H6N2O.C6H7NO/c1-9(2)7-3-5-8-6-4-7;7-6(9)5-2-1-3-8-4-5;1-8-6-2-4-7-5-3-6/h3-6H,1-2H3;1-4H,(H2,7,9);2-5H,1H3/p+3