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

Systemtic Name: tert-butyl N-[3-(2-nitroimidazol-1-yl)propyl]carbamate Openeye Name: tert-butyl N-[3-(2-nitroimidazol-1-yl)propyl]carbamate CAS Name: N-[3-(2-nitro-1-imidazolyl)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(2-nitroimidazol-1-yl)propyl]carbamate Traditional Name: N-[3-(2-nitroimidazol-1-yl)propyl]carbamic acid tert-butyl ester Formula: C11H18N4O4 MolecularWeight: 270.28502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCN1C=CN=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NCCCN1C=CN=C1[N+](=O)[O-]

InChI

InChI=1S/C11H18N4O4/c1-11(2,3)19-10(16)13-5-4-7-14-8-6-12-9(14)15(17)18/h6,8H,4-5,7H2,1-3H3,(H,13,16)