methyl-[3-[(5-methylpyridin-1-ium-2-yl)amino]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[(5-methylpyridin-1-ium-2-yl)amino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[(5-methylpyridin-1-ium-2-yl)amino]propyl]ammonium CAS Name: methyl-[3-[(5-methyl-2-pyridin-1-iumyl)amino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[(5-methylpyridin-1-ium-2-yl)amino]propyl]azanium Traditional Name: benzyl-methyl-[3-[(5-methylpyridin-1-ium-2-yl)amino]propyl]ammonium Formula: C17H25N3+2 MolecularWeight: 271.4005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)NCCC[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC1=C[NH+]=C(C=C1)NCCC[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C17H23N3/c1-15-9-10-17(19-13-15)18-11-6-12-20(2)14-16-7-4-3-5-8-16/h3-5,7-10,13H,6,11-12,14H2,1-2H3,(H,18,19)/p+2