5-[[[diethoxyphosphoryl(phenyl)methyl]amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 5-[[[diethoxyphosphoryl(phenyl)methyl]amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 5-[[[diethoxyphosphoryl(phenyl)methyl]amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: 5-[[[diethoxyphosphoryl(phenyl)methyl]amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 5-[[[diethoxyphosphoryl(phenyl)methyl]amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 5-[[[diethoxyphosphoryl(phenyl)methyl]amino]methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C20H23N4O7P MolecularWeight: 462.392981

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=CC=C1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-])OCC

Isomeric SMILES

CCOP(=O)(C(C1=CC=CC=C1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-])OCC

InChI

InChI=1S/C20H23N4O7P/c1-3-30-32(29,31-4-2)20(13-8-6-5-7-9-13)21-12-14-10-15(24(27)28)11-16-17(14)23-19(26)18(25)22-16/h5-11,20-21H,3-4,12H2,1-2H3,(H,22,25)(H,23,26)