dimethyl-[[4-[[(3-nitropyridin-1-ium-2-yl)amino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[(3-nitropyridin-1-ium-2-yl)amino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[(3-nitropyridin-1-ium-2-yl)amino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[(3-nitro-2-pyridin-1-iumyl)amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[(3-nitropyridin-1-ium-2-yl)amino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[[(3-nitropyridin-1-ium-2-yl)amino]methyl]benzyl]ammonium Formula: C15H20N4O2+2 MolecularWeight: 288.3449

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O2/c1-18(2)11-13-7-5-12(6-8-13)10-17-15-14(19(20)21)4-3-9-16-15/h3-9H,10-11H2,1-2H3,(H,16,17)/p+2