8-(benzamidomethyl)-6-nitro-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-2-carboxylic acid

Systemtic Name: 8-(benzamidomethyl)-6-nitro-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Openeye Name: 8-(benzamidomethyl)-6-nitro-3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid CAS Name: 8-(benzamidomethyl)-6-nitro-3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid IUPAC Name: 8-(benzamidomethyl)-6-nitro-3-oxo-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Traditional Name: 8-(benzamidomethyl)-3-keto-6-nitro-2,4-dihydro-1H-quinoxaline-2-carboxylic acid Formula: C17H14N4O6 MolecularWeight: 370.31626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCC2=CC(=CC3=C2NC(C(=O)N3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCC2=CC(=CC3=C2NC(C(=O)N3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O6/c22-15(9-4-2-1-3-5-9)18-8-10-6-11(21(26)27)7-12-13(10)20-14(17(24)25)16(23)19-12/h1-7,14,20H,8H2,(H,18,22)(H,19,23)(H,24,25)