N-[(4-dimethylaminophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-[(4-dimethylaminophenyl)methyl]-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[(4-dimethylaminophenyl)methyl]-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-3-nitropyridin-1-ium-2-amine Traditional Name: dimethyl-[4-[[(3-nitropyridin-1-ium-2-yl)amino]methyl]phenyl]amine Formula: C14H17N4O2+ MolecularWeight: 273.31038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O2/c1-17(2)12-7-5-11(6-8-12)10-16-14-13(18(19)20)4-3-9-15-14/h3-9H,10H2,1-2H3,(H,15,16)/p+1