1-(5-nitropyridin-2-yl)-4-(pyridin-2-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(5-nitropyridin-2-yl)-4-(pyridin-2-ylmethyl)piperazin-4-ium Openeye Name: 1-(5-nitro-2-pyridyl)-4-(2-pyridylmethyl)piperazin-4-ium CAS Name: 1-(5-nitro-2-pyridinyl)-4-(2-pyridinylmethyl)piperazin-4-ium IUPAC Name: 1-(5-nitropyridin-2-yl)-4-(pyridin-2-ylmethyl)piperazin-4-ium Traditional Name: 1-(5-nitro-2-pyridyl)-4-(2-pyridylmethyl)piperazin-4-ium Formula: C15H18N5O2+ MolecularWeight: 300.33572

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O2/c21-20(22)14-4-5-15(17-11-14)19-9-7-18(8-10-19)12-13-3-1-2-6-16-13/h1-6,11H,7-10,12H2/p+1