4-(diethoxyphosphorylmethyl)-1-(2,4-dimethylimidazol-1-yl)-6-nitro-quinoxaline-2,3-dione

Systemtic Name: 4-(diethoxyphosphorylmethyl)-1-(2,4-dimethylimidazol-1-yl)-6-nitro-quinoxaline-2,3-dione Openeye Name: 4-(diethoxyphosphorylmethyl)-1-(2,4-dimethylimidazol-1-yl)-6-nitro-quinoxaline-2,3-dione CAS Name: 4-(diethoxyphosphorylmethyl)-1-(2,4-dimethyl-1-imidazolyl)-6-nitroquinoxaline-2,3-dione IUPAC Name: 4-(diethoxyphosphorylmethyl)-1-(2,4-dimethylimidazol-1-yl)-6-nitroquinoxaline-2,3-dione Traditional Name: 4-(diethoxyphosphorylmethyl)-1-(2,4-dimethylimidazol-1-yl)-6-nitro-quinoxaline-2,3-quinone Formula: C18H22N5O7P MolecularWeight: 451.370341

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CN1C2=C(C=CC(=C2)[N+](=O)[O-])N(C(=O)C1=O)N3C=C(N=C3C)C)OCC

Isomeric SMILES

CCOP(=O)(CN1C2=C(C=CC(=C2)[N+](=O)[O-])N(C(=O)C1=O)N3C=C(N=C3C)C)OCC

InChI

InChI=1S/C18H22N5O7P/c1-5-29-31(28,30-6-2)11-20-16-9-14(23(26)27)7-8-15(16)22(18(25)17(20)24)21-10-12(3)19-13(21)4/h7-10H,5-6,11H2,1-4H3