tert-butyl N-[(2S)-3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-(2-nitroimidazol-1-yl)-2-oxidanyl-propyl]carbamate Openeye Name: tert-butyl N-[(2S)-2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]carbamate CAS Name: N-[(2S)-2-hydroxy-3-(2-nitro-1-imidazolyl)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]carbamate Traditional Name: N-[(2S)-2-hydroxy-3-(2-nitroimidazol-1-yl)propyl]carbamic acid tert-butyl ester Formula: C11H18N4O5 MolecularWeight: 286.28442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(CN1C=CN=C1[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)NC[C@@H](CN1C=CN=C1[N+](=O)[O-])O

InChI

InChI=1S/C11H18N4O5/c1-11(2,3)20-10(17)13-6-8(16)7-14-5-4-12-9(14)15(18)19/h4-5,8,16H,6-7H2,1-3H3,(H,13,17)/t8-/m0/s1