2-azanyl-N-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]-3-oxidanyl-butanamide

Systemtic Name: 2-azanyl-N-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]-3-oxidanyl-butanamide Openeye Name: 2-amino-3-hydroxy-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]butanamide CAS Name: 2-amino-3-hydroxy-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]butanamide IUPAC Name: 2-amino-3-hydroxy-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]butanamide Traditional Name: 2-amino-N-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)methyl]-3-hydroxy-butyramide Formula: C13H15N5O6 MolecularWeight: 337.2881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NCC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])N)O

Isomeric SMILES

CC(C(C(=O)NCC1=CC(=CC2=C1NC(=O)C(=O)N2)[N+](=O)[O-])N)O

InChI

InChI=1S/C13H15N5O6/c1-5(19)9(14)11(20)15-4-6-2-7(18(23)24)3-8-10(6)17-13(22)12(21)16-8/h2-3,5,9,19H,4,14H2,1H3,(H,15,20)(H,16,21)(H,17,22)