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

Systemtic Name: 2-azanyl-3-methyl-N-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]butanamide Openeye Name: 2-amino-3-methyl-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]butanamide CAS Name: 2-amino-3-methyl-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]butanamide IUPAC Name: 2-amino-3-methyl-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-methyl-butyramide Formula: C14H17N5O5 MolecularWeight: 335.31528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O5/c1-6(2)10(15)12(20)16-5-7-3-8(19(23)24)4-9-11(7)18-14(22)13(21)17-9/h3-4,6,10H,5,15H2,1-2H3,(H,16,20)(H,17,21)(H,18,22)