N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-3-nitro-pyridin-1-ium-2-amine CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-3-nitropyridin-1-ium-2-amine Traditional Name: (2-methyl-2-morpholin-4-ium-4-yl-propyl)-(3-nitropyridin-1-ium-2-yl)amine Formula: C13H22N4O3+2 MolecularWeight: 282.33878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(C=CC=[NH+]1)[N+](=O)[O-])[NH+]2CCOCC2

Isomeric SMILES

CC(C)(CNC1=C(C=CC=[NH+]1)[N+](=O)[O-])[NH+]2CCOCC2

InChI

InChI=1S/C13H20N4O3/c1-13(2,16-6-8-20-9-7-16)10-15-12-11(17(18)19)4-3-5-14-12/h3-5H,6-10H2,1-2H3,(H,14,15)/p+2