N-(3-imidazol-1-ylpropyl)-5-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-nitro-pyridin-1-ium-2-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-5-nitro-pyridin-1-ium-2-amine CAS Name: N-[3-(1-imidazolyl)propyl]-5-nitro-2-pyridin-1-iumamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-nitropyridin-1-ium-2-amine Traditional Name: 3-imidazol-1-ylpropyl-(5-nitropyridin-1-ium-2-yl)amine Formula: C11H14N5O2+ MolecularWeight: 248.26116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=[NH+]C=C1[N+](=O)[O-])NCCCN2C=CN=C2

Isomeric SMILES

C1=CC(=[NH+]C=C1[N+](=O)[O-])NCCCN2C=CN=C2

InChI

InChI=1S/C11H13N5O2/c17-16(18)10-2-3-11(14-8-10)13-4-1-6-15-7-5-12-9-15/h2-3,5,7-9H,1,4,6H2,(H,13,14)/p+1