tert-butyl N-[1-[[(2E)-1-ethoxy-2-hydroxyimino-3-methyl-butyl]-methyl-amino]oxy-2-(2-nitroimidazol-1-yl)ethyl]carbamate

Systemtic Name: tert-butyl N-[1-[[(2E)-1-ethoxy-2-hydroxyimino-3-methyl-butyl]-methyl-amino]oxy-2-(2-nitroimidazol-1-yl)ethyl]carbamate Openeye Name: tert-butyl N-[1-[[(2E)-1-ethoxy-2-hydroxyimino-3-methyl-butyl]-methyl-amino]oxy-2-(2-nitroimidazol-1-yl)ethyl]carbamate CAS Name: N-[1-[[(2E)-1-ethoxy-2-hydroxyimino-3-methylbutyl]-methylamino]oxy-2-(2-nitro-1-imidazolyl)ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[[(2E)-1-ethoxy-2-hydroxyimino-3-methylbutyl]-methylamino]oxy-2-(2-nitroimidazol-1-yl)ethyl]carbamate Traditional Name: N-[1-[[(2E)-1-ethoxy-2-hydroximino-3-methyl-butyl]-methyl-amino]oxy-2-(2-nitroimidazol-1-yl)ethyl]carbamic acid tert-butyl ester Formula: C18H32N6O7 MolecularWeight: 444.48268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=NO)C(C)C)N(C)OC(CN1C=CN=C1[N+](=O)[O-])NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(/C(=N/O)/C(C)C)N(C)OC(CN1C=CN=C1[N+](=O)[O-])NC(=O)OC(C)(C)C

InChI

InChI=1S/C18H32N6O7/c1-8-29-15(14(21-26)12(2)3)22(7)31-13(20-17(25)30-18(4,5)6)11-23-10-9-19-16(23)24(27)28/h9-10,12-13,15,26H,8,11H2,1-7H3,(H,20,25)/b21-14+