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

Systemtic Name: 2-azanyl-3-(1H-imidazol-5-yl)-N-[[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]propanamide Openeye Name: 2-amino-3-(1H-imidazol-5-yl)-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]propanamide CAS Name: 2-amino-3-(1H-imidazol-5-yl)-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]propanamide IUPAC Name: 2-amino-3-(1H-imidazol-5-yl)-N-[(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]propanamide Traditional Name: 2-amino-N-[(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)methyl]-3-(1H-imidazol-5-yl)propionamide Formula: C15H15N7O5 MolecularWeight: 373.3235

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1NC(=O)C(=O)N2)CNC(=O)C(CC3=CN=CN3)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C2=C1NC(=O)C(=O)N2)CNC(=O)C(CC3=CN=CN3)N)[N+](=O)[O-]

InChI

InChI=1S/C15H15N7O5/c16-10(2-8-5-17-6-19-8)13(23)18-4-7-1-9(22(26)27)3-11-12(7)21-15(25)14(24)20-11/h1,3,5-6,10H,2,4,16H2,(H,17,19)(H,18,23)(H,20,24)(H,21,25)