2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-5-nitro-pyridine

Systemtic Name: 2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-5-nitro-pyridine Openeye Name: 2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-5-nitro-pyridine CAS Name: 2-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-5-nitropyridine IUPAC Name: 2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-5-nitropyridine Traditional Name: 2-[(3S,5S)-3,5-dimethylpiperidino]-5-nitro-pyridine Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O2/c1-9-5-10(2)8-14(7-9)12-4-3-11(6-13-12)15(16)17/h3-4,6,9-10H,5,7-8H2,1-2H3/t9-,10-/m0/s1