1-[(4S)-2,6-dimethoxy-5-nitro-1,4-dihydropyrimidin-4-yl]propan-2-one

Systemtic Name: 1-[(4S)-2,6-dimethoxy-5-nitro-1,4-dihydropyrimidin-4-yl]propan-2-one Openeye Name: 1-[(4S)-2,6-dimethoxy-5-nitro-1,4-dihydropyrimidin-4-yl]propan-2-one CAS Name: 1-[(4S)-2,6-dimethoxy-5-nitro-1,4-dihydropyrimidin-4-yl]-2-propanone IUPAC Name: 1-[(4S)-2,6-dimethoxy-5-nitro-1,4-dihydropyrimidin-4-yl]propan-2-one Traditional Name: 1-[(4S)-2,6-dimethoxy-5-nitro-1,4-dihydropyrimidin-4-yl]acetone Formula: C9H13N3O5 MolecularWeight: 243.21662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1C(=C(NC(=N1)OC)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C9H13N3O5/c1-5(13)4-6-7(12(14)15)8(16-2)11-9(10-6)17-3/h6H,4H2,1-3H3,(H,10,11)/t6-/m0/s1