N-(3-imidazol-1-ylpropyl)-5-methyl-pyridin-1-ium-2-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-methyl-pyridin-1-ium-2-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-5-methyl-pyridin-1-ium-2-amine CAS Name: N-[3-(1-imidazolyl)propyl]-5-methyl-2-pyridin-1-iumamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-methylpyridin-1-ium-2-amine Traditional Name: 3-imidazol-1-ylpropyl-(5-methylpyridin-1-ium-2-yl)amine Formula: C12H17N4+ MolecularWeight: 217.29018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)NCCCN2C=CN=C2

Isomeric SMILES

CC1=C[NH+]=C(C=C1)NCCCN2C=CN=C2

InChI

InChI=1S/C12H16N4/c1-11-3-4-12(15-9-11)14-5-2-7-16-8-6-13-10-16/h3-4,6,8-10H,2,5,7H2,1H3,(H,14,15)/p+1