ethyl 4-[2-(4-nitroimidazol-1-yl)ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-nitroimidazol-1-yl)ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-nitroimidazol-1-yl)acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-nitro-1-imidazolyl)-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-nitroimidazol-1-yl)acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-nitroimidazol-1-yl)acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C12H17N5O5 MolecularWeight: 311.29388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N5O5/c1-2-22-12(19)16-5-3-15(4-6-16)11(18)8-14-7-10(13-9-14)17(20)21/h7,9H,2-6,8H2,1H3