2-(5-nitroimidazol-1-yl)ethyl ethanoate

Systemtic Name: 2-(5-nitroimidazol-1-yl)ethyl ethanoate Openeye Name: 2-(5-nitroimidazol-1-yl)ethyl acetate CAS Name: acetic acid 2-(5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(5-nitroimidazol-1-yl)ethyl acetate Traditional Name: acetic acid 2-(5-nitroimidazol-1-yl)ethyl ester Formula: C7H9N3O4 MolecularWeight: 199.16406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C=NC=C1[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCN1C=NC=C1[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O4/c1-6(11)14-3-2-9-5-8-4-7(9)10(12)13/h4-5H,2-3H2,1H3