N-methyl-3-nitro-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine

Systemtic Name: N-methyl-3-nitro-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine Openeye Name: N-methyl-3-nitro-N-[2-(2-pyridyl)ethyl]pyridin-1-ium-2-amine CAS Name: N-methyl-3-nitro-N-[2-(2-pyridinyl)ethyl]-2-pyridin-1-iumamine IUPAC Name: N-methyl-3-nitro-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine Traditional Name: methyl-(3-nitropyridin-1-ium-2-yl)-[2-(2-pyridyl)ethyl]amine Formula: C13H15N4O2+ MolecularWeight: 259.2838

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O2/c1-16(10-7-11-5-2-3-8-14-11)13-12(17(18)19)6-4-9-15-13/h2-6,8-9H,7,10H2,1H3/p+1