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

Systemtic Name: 7-nitro-5-[(3-oxidanylpiperidin-1-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 5-[(3-hydroxy-1-piperidyl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: 5-[(3-hydroxy-1-piperidinyl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 5-[(3-hydroxypiperidin-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 5-[(3-hydroxypiperidino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C14H16N4O5 MolecularWeight: 320.30064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-])O

Isomeric SMILES

C1CC(CN(C1)CC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-])O

InChI

InChI=1S/C14H16N4O5/c19-10-2-1-3-17(7-10)6-8-4-9(18(22)23)5-11-12(8)16-14(21)13(20)15-11/h4-5,10,19H,1-3,6-7H2,(H,15,20)(H,16,21)