N2-methyl-N2-(1-methylpiperidin-1-ium-4-yl)pyridin-1-ium-2,3-diamine

Systemtic Name: N2-methyl-N2-(1-methylpiperidin-1-ium-4-yl)pyridin-1-ium-2,3-diamine Openeye Name: N2-methyl-N2-(1-methylpiperidin-1-ium-4-yl)pyridin-1-ium-2,3-diamine CAS Name: N2-methyl-N2-(1-methyl-4-piperidin-1-iumyl)pyridin-1-ium-2,3-diamine IUPAC Name: 2-N-methyl-2-N-(1-methylpiperidin-1-ium-4-yl)pyridin-1-ium-2,3-diamine Traditional Name: (3-aminopyridin-1-ium-2-yl)-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C12H22N4+2 MolecularWeight: 222.32988

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C2=C(C=CC=[NH+]2)N

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C2=C(C=CC=[NH+]2)N

InChI

InChI=1S/C12H20N4/c1-15-8-5-10(6-9-15)16(2)12-11(13)4-3-7-14-12/h3-4,7,10H,5-6,8-9,13H2,1-2H3/p+2