6-azanyl-5-[1-(3-methoxy-4-phenylmethoxy-phenyl)-2-nitro-ethyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[1-(3-methoxy-4-phenylmethoxy-phenyl)-2-nitro-ethyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[1-(4-benzyloxy-3-methoxy-phenyl)-2-nitro-ethyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[1-(3-methoxy-4-phenylmethoxyphenyl)-2-nitroethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[1-(3-methoxy-4-phenylmethoxyphenyl)-2-nitroethyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[1-(4-benzoxy-3-methoxy-phenyl)-2-nitro-ethyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C(C[N+](=O)[O-])C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C(C[N+](=O)[O-])C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)N

InChI

InChI=1S/C22H24N4O6/c1-24-20(23)19(21(27)25(2)22(24)28)16(12-26(29)30)15-9-10-17(18(11-15)31-3)32-13-14-7-5-4-6-8-14/h4-11,16H,12-13,23H2,1-3H3