6-azanyl-5-[(1R,2R)-1-(3-methoxyphenyl)-2-nitro-propyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[(1R,2R)-1-(3-methoxyphenyl)-2-nitro-propyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[(1R,2R)-1-(3-methoxyphenyl)-2-nitro-propyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[(1R,2R)-1-(3-methoxyphenyl)-2-nitropropyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[(1R,2R)-1-(3-methoxyphenyl)-2-nitropropyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[(1R,2R)-1-(3-methoxyphenyl)-2-nitro-propyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC(=CC=C1)OC)C2=C(N(C(=O)N(C2=O)C)C)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]([C@H](C1=CC(=CC=C1)OC)C2=C(N(C(=O)N(C2=O)C)C)N)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O5/c1-9(20(23)24)12(10-6-5-7-11(8-10)25-4)13-14(17)18(2)16(22)19(3)15(13)21/h5-9,12H,17H2,1-4H3/t9-,12-/m1/s1