N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-nitro-pyridin-2-amine

Systemtic Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-nitro-pyridin-2-amine Openeye Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-nitro-pyridin-2-amine CAS Name: N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-3-nitro-2-pyridinamine IUPAC Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-3-nitropyridin-2-amine Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-(3-nitro-2-pyridyl)amine Formula: C14H23N4O2+ MolecularWeight: 279.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC2=C(C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC2=C(C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H22N4O2/c1-12-6-2-3-10-17(12)11-5-9-16-14-13(18(19)20)7-4-8-15-14/h4,7-8,12H,2-3,5-6,9-11H2,1H3,(H,15,16)/p+1/t12-/m0/s1