5-nitro-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine

Systemtic Name: 5-nitro-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine Openeye Name: 5-nitro-N-[2-(2-pyridyl)ethyl]pyridin-1-ium-2-amine CAS Name: 5-nitro-N-[2-(2-pyridinyl)ethyl]-2-pyridin-1-iumamine IUPAC Name: 5-nitro-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine Traditional Name: (5-nitropyridin-1-ium-2-yl)-[2-(2-pyridyl)ethyl]amine Formula: C12H13N4O2+ MolecularWeight: 245.25722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCNC2=[NH+]C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CCNC2=[NH+]C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O2/c17-16(18)11-4-5-12(15-9-11)14-8-6-10-3-1-2-7-13-10/h1-5,7,9H,6,8H2,(H,14,15)/p+1