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

Systemtic Name: 6-nitro-7-[(4-oxidanylpiperidin-1-yl)methyl]-1,4-dihydroquinoxaline-2,3-dione hydrochloride Openeye Name: 6-[(4-hydroxy-1-piperidyl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrochloride CAS Name: 6-[(4-hydroxy-1-piperidinyl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrochloride IUPAC Name: 6-[(4-hydroxypiperidin-1-yl)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione hydrochloride Traditional Name: 6-[(4-hydroxypiperidino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone hydrochloride Formula: C14H17ClN4O5 MolecularWeight: 356.76158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)CC2=CC3=C(C=C2[N+](=O)[O-])NC(=O)C(=O)N3.Cl

Isomeric SMILES

C1CN(CCC1O)CC2=CC3=C(C=C2[N+](=O)[O-])NC(=O)C(=O)N3.Cl

InChI

InChI=1S/C14H16N4O5.ClH/c19-9-1-3-17(4-2-9)7-8-5-10-11(6-12(8)18(22)23)16-14(21)13(20)15-10;/h5-6,9,19H,1-4,7H2,(H,15,20)(H,16,21);1H