3-methyl-3-[2-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]ethoxyamino]-1-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propoxy]butan-2-one

Systemtic Name: 3-methyl-3-[2-[(2-methyl-3-oxidanylidene-butan-2-yl)amino]ethoxyamino]-1-[3-(2-nitroimidazol-1-yl)-2-oxidanyl-propoxy]butan-2-one Openeye Name: 3-[2-[(1,1-dimethyl-2-oxo-propyl)amino]ethoxyamino]-1-[2-hydroxy-3-(2-nitroimidazol-1-yl)propoxy]-3-methyl-butan-2-one CAS Name: 1-[2-hydroxy-3-(2-nitro-1-imidazolyl)propoxy]-3-methyl-3-[2-[(2-methyl-3-oxobutan-2-yl)amino]ethoxyamino]-2-butanone IUPAC Name: 1-[2-hydroxy-3-(2-nitroimidazol-1-yl)propoxy]-3-methyl-3-[2-[(2-methyl-3-oxobutan-2-yl)amino]ethoxyamino]butan-2-one Traditional Name: 1-[2-hydroxy-3-(2-nitroimidazol-1-yl)propoxy]-3-[2-[(2-keto-1,1-dimethyl-propyl)amino]ethoxyamino]-3-methyl-butan-2-one Formula: C18H31N5O7 MolecularWeight: 429.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)NCCONC(C)(C)C(=O)COCC(CN1C=CN=C1[N+](=O)[O-])O

Isomeric SMILES

CC(=O)C(C)(C)NCCONC(C)(C)C(=O)COCC(CN1C=CN=C1[N+](=O)[O-])O

InChI

InChI=1S/C18H31N5O7/c1-13(24)17(2,3)20-7-9-30-21-18(4,5)15(26)12-29-11-14(25)10-22-8-6-19-16(22)23(27)28/h6,8,14,20-21,25H,7,9-12H2,1-5H3