7-nitro-5-[(4-oxidanylidenepiperidin-1-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide

Systemtic Name: 7-nitro-5-[(4-oxidanylidenepiperidin-1-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide Openeye Name: 7-nitro-5-[(4-oxo-1-piperidyl)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide CAS Name: 7-nitro-5-[(4-oxo-1-piperidinyl)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide IUPAC Name: 7-nitro-5-[(4-oxopiperidin-1-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrobromide Traditional Name: 5-[(4-ketopiperidino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone hydrobromide Formula: C14H15BrN4O5 MolecularWeight: 399.1967

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-].Br

Isomeric SMILES

C1CN(CCC1=O)CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-].Br

InChI

InChI=1S/C14H14N4O5.BrH/c19-10-1-3-17(4-2-10)7-8-5-9(18(22)23)6-11-12(8)16-14(21)13(20)15-11;/h5-6H,1-4,7H2,(H,15,20)(H,16,21);1H