4-(4-nitroimidazol-1-yl)butyl carbamate

Systemtic Name: 4-(4-nitroimidazol-1-yl)butyl carbamate Openeye Name: 4-(4-nitroimidazol-1-yl)butyl carbamate CAS Name: carbamic acid 4-(4-nitro-1-imidazolyl)butyl ester IUPAC Name: 4-(4-nitroimidazol-1-yl)butyl carbamate Traditional Name: carbamic acid 4-(4-nitroimidazol-1-yl)butyl ester Formula: C8H12N4O4 MolecularWeight: 228.20528

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=CN1CCCCOC(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(N=CN1CCCCOC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C8H12N4O4/c9-8(13)16-4-2-1-3-11-5-7(10-6-11)12(14)15/h5-6H,1-4H2,(H2,9,13)