4-(1-diethoxyphosphorylethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione

Systemtic Name: 4-(1-diethoxyphosphorylethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione Openeye Name: 4-(1-diethoxyphosphorylethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione CAS Name: 4-(1-diethoxyphosphorylethyl)-6-(1-imidazolyl)-7-nitro-1H-quinoxaline-2,3-dione IUPAC Name: 4-(1-diethoxyphosphorylethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-dione Traditional Name: 4-(1-diethoxyphosphorylethyl)-6-imidazol-1-yl-7-nitro-1H-quinoxaline-2,3-quinone Formula: C17H20N5O7P MolecularWeight: 437.343761

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C)N1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])N3C=CN=C3)OCC

Isomeric SMILES

CCOP(=O)(C(C)N1C2=CC(=C(C=C2NC(=O)C1=O)[N+](=O)[O-])N3C=CN=C3)OCC

InChI

InChI=1S/C17H20N5O7P/c1-4-28-30(27,29-5-2)11(3)21-13-9-14(20-7-6-18-10-20)15(22(25)26)8-12(13)19-16(23)17(21)24/h6-11H,4-5H2,1-3H3,(H,19,23)