2-[2-[(Z)-N'-acetyloxycarbamimidoyl]-5-nitro-imidazol-1-yl]ethyl ethanoate

Systemtic Name: 2-[2-[(Z)-N'-acetyloxycarbamimidoyl]-5-nitro-imidazol-1-yl]ethyl ethanoate Openeye Name: 2-[2-[(Z)-N'-acetoxycarbamimidoyl]-5-nitro-imidazol-1-yl]ethyl acetate CAS Name: acetic acid 2-[2-[(Z)-acetyloxyimino(amino)methyl]-5-nitro-1-imidazolyl]ethyl ester IUPAC Name: 2-[2-[(Z)-N'-acetyloxycarbamimidoyl]-5-nitroimidazol-1-yl]ethyl acetate Traditional Name: acetic acid 2-[2-[(Z)-N'-acetoxyamidino]-5-nitro-imidazol-1-yl]ethyl ester Formula: C10H13N5O6 MolecularWeight: 299.24012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C(=CN=C1C(=NOC(=O)C)N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCN1C(=CN=C1/C(=N/OC(=O)C)/N)[N+](=O)[O-]

InChI

InChI=1S/C10H13N5O6/c1-6(16)20-4-3-14-8(15(18)19)5-12-10(14)9(11)13-21-7(2)17/h5H,3-4H2,1-2H3,(H2,11,13)