5-(methylaminomethyl)-7-nitro-1,4-dihydroquinoxaline-2,3-dione; oxidanyl-oxidanylidene-(phenylmethyl)phosphanium

Systemtic Name: 5-(methylaminomethyl)-7-nitro-1,4-dihydroquinoxaline-2,3-dione; oxidanyl-oxidanylidene-(phenylmethyl)phosphanium Openeye Name: benzyl-hydroxy-oxo-phosphonium; 5-(methylaminomethyl)-7-nitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: hydroxy-oxo-(phenylmethyl)phosphonium; 5-(methylaminomethyl)-7-nitro-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: benzyl-hydroxy-oxophosphanium; 5-(methylaminomethyl)-7-nitro-1,4-dihydroquinoxaline-2,3-dione Traditional Name: benzyl-hydroxy-keto-phosphonium; 5-(methylaminomethyl)-7-nitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C17H18N4O6P+ MolecularWeight: 405.321781

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-].C1=CC=C(C=C1)C[P+](=O)O

Isomeric SMILES

CNCC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-].C1=CC=C(C=C1)C[P+](=O)O

InChI

InChI=1S/C10H10N4O4.C7H7O2P/c1-11-4-5-2-6(14(17)18)3-7-8(5)13-10(16)9(15)12-7;8-10(9)6-7-4-2-1-3-5-7/h2-3,11H,4H2,1H3,(H,12,15)(H,13,16);1-5H,6H2/p+1