3-[(5-methylpyridin-1-ium-2-yl)-(pyridin-3-ylmethyl)amino]propylazanium

Systemtic Name: 3-[(5-methylpyridin-1-ium-2-yl)-(pyridin-3-ylmethyl)amino]propylazanium Openeye Name: 3-[(5-methylpyridin-1-ium-2-yl)-(3-pyridylmethyl)amino]propylammonium CAS Name: 3-[(5-methyl-2-pyridin-1-iumyl)-(3-pyridinylmethyl)amino]propylammonium IUPAC Name: 3-[(5-methylpyridin-1-ium-2-yl)-(pyridin-3-ylmethyl)amino]propylazanium Traditional Name: 3-[(5-methylpyridin-1-ium-2-yl)-(3-pyridylmethyl)amino]propylammonium Formula: C15H22N4+2 MolecularWeight: 258.36198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)N(CCC[NH3+])CC2=CN=CC=C2

Isomeric SMILES

CC1=C[NH+]=C(C=C1)N(CCC[NH3+])CC2=CN=CC=C2

InChI

InChI=1S/C15H20N4/c1-13-5-6-15(18-10-13)19(9-3-7-16)12-14-4-2-8-17-11-14/h2,4-6,8,10-11H,3,7,9,12,16H2,1H3/p+2