(2R,5S)-3,6-dimethoxy-2-[(2R)-1-nitropropan-2-yl]-5-propan-2-yl-2,5-dihydropyrazine

Systemtic Name: (2R,5S)-3,6-dimethoxy-2-[(2R)-1-nitropropan-2-yl]-5-propan-2-yl-2,5-dihydropyrazine Openeye Name: (2S,5R)-2-isopropyl-3,6-dimethoxy-5-[(1R)-1-methyl-2-nitro-ethyl]-2,5-dihydropyrazine CAS Name: (2R,5S)-3,6-dimethoxy-2-[(2R)-1-nitropropan-2-yl]-5-propan-2-yl-2,5-dihydropyrazine IUPAC Name: (2R,5S)-3,6-dimethoxy-2-[(2R)-1-nitropropan-2-yl]-5-propan-2-yl-2,5-dihydropyrazine Traditional Name: (2S,5R)-2-isopropyl-3,6-dimethoxy-5-[(1R)-1-methyl-2-nitro-ethyl]-2,5-dihydropyrazine Formula: C12H21N3O4 MolecularWeight: 271.31284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=NC(C(=N1)OC)C(C)C[N+](=O)[O-])OC

Isomeric SMILES

C[C@H](C[N+](=O)[O-])[C@@H]1C(=N[C@H](C(=N1)OC)C(C)C)OC

InChI

InChI=1S/C12H21N3O4/c1-7(2)9-11(18-4)14-10(12(13-9)19-5)8(3)6-15(16)17/h7-10H,6H2,1-5H3/t8-,9+,10-/m1/s1