3-[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]-N-(4-nitrophenyl)propanamide Openeye Name: 3-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)-N-(4-nitrophenyl)propanamide CAS Name: 3-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)-N-(4-nitrophenyl)propanamide IUPAC Name: 3-(7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)-N-(4-nitrophenyl)propanamide Traditional Name: 3-(2,3-diketo-7-nitro-1,4-dihydroquinoxalin-5-yl)-N-(4-nitrophenyl)propionamide Formula: C17H13N5O7 MolecularWeight: 399.31442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O7/c23-14(18-10-2-4-11(5-3-10)21(26)27)6-1-9-7-12(22(28)29)8-13-15(9)20-17(25)16(24)19-13/h2-5,7-8H,1,6H2,(H,18,23)(H,19,24)(H,20,25)