2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N4-methyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N4-methyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: 2-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-N4-methyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-4-N-methyl-5-nitropyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(3R,5R)-3,5-dimethylpiperidino]-5-nitro-pyrimidin-4-yl]-methyl-amine Formula: C12H20N6O2 MolecularWeight: 280.3262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC(=C(C(=N2)NC)[N+](=O)[O-])N)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C2=NC(=C(C(=N2)NC)[N+](=O)[O-])N)C

InChI

InChI=1S/C12H20N6O2/c1-7-4-8(2)6-17(5-7)12-15-10(13)9(18(19)20)11(14-3)16-12/h7-8H,4-6H2,1-3H3,(H3,13,14,15,16)/t7-,8-/m1/s1