N,N-dimethyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-(3-nitro-2-pyridin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-(3-nitropyridin-1-ium-2-yl)piperazin-1-ium-1-yl]acetamide Formula: C13H21N5O3+2 MolecularWeight: 295.33754

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C13H19N5O3/c1-15(2)12(19)10-16-6-8-17(9-7-16)13-11(18(20)21)4-3-5-14-13/h3-5H,6-10H2,1-2H3/p+2