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

Systemtic Name: 6-azanyl-5-[(1R,2R)-1-(3,5-dimethoxyphenyl)-2-nitro-butyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[(1R,2R)-1-(3,5-dimethoxyphenyl)-2-nitro-butyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[(1R,2R)-1-(3,5-dimethoxyphenyl)-2-nitrobutyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[(1R,2R)-1-(3,5-dimethoxyphenyl)-2-nitrobutyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[(1R,2R)-1-(3,5-dimethoxyphenyl)-2-nitro-butyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H24N4O6 MolecularWeight: 392.40636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O6/c1-6-13(22(25)26)14(10-7-11(27-4)9-12(8-10)28-5)15-16(19)20(2)18(24)21(3)17(15)23/h7-9,13-14H,6,19H2,1-5H3/t13-,14+/m1/s1