4-[(1-azido-3-oxidanyl-propan-2-yl)oxyamino]-4-methyl-1-(2-nitroimidazol-1-yl)pentan-3-one

Systemtic Name: 4-[(1-azido-3-oxidanyl-propan-2-yl)oxyamino]-4-methyl-1-(2-nitroimidazol-1-yl)pentan-3-one Openeye Name: 4-[[1-(azidomethyl)-2-hydroxy-ethoxy]amino]-4-methyl-1-(2-nitroimidazol-1-yl)pentan-3-one CAS Name: 4-[(1-azido-3-hydroxypropan-2-yl)oxyamino]-4-methyl-1-(2-nitro-1-imidazolyl)-3-pentanone IUPAC Name: 4-[(1-azido-3-hydroxypropan-2-yl)oxyamino]-4-methyl-1-(2-nitroimidazol-1-yl)pentan-3-one Traditional Name: 4-[[1-(azidomethyl)-2-hydroxy-ethoxy]amino]-4-methyl-1-(2-nitroimidazol-1-yl)pentan-3-one Formula: C12H19N7O5 MolecularWeight: 341.32316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)CCN1C=CN=C1[N+](=O)[O-])NOC(CN=[N+]=[N-])CO

Isomeric SMILES

CC(C)(C(=O)CCN1C=CN=C1[N+](=O)[O-])NOC(CN=[N+]=[N-])CO

InChI

InChI=1S/C12H19N7O5/c1-12(2,16-24-9(8-20)7-15-17-13)10(21)3-5-18-6-4-14-11(18)19(22)23/h4,6,9,16,20H,3,5,7-8H2,1-2H3