[2-[(2-nitroimidazol-1-yl)methoxy]-3-oxidanyl-propyl] ethanoate

Systemtic Name: [2-[(2-nitroimidazol-1-yl)methoxy]-3-oxidanyl-propyl] ethanoate Openeye Name: [3-hydroxy-2-[(2-nitroimidazol-1-yl)methoxy]propyl] acetate CAS Name: acetic acid [3-hydroxy-2-[(2-nitro-1-imidazolyl)methoxy]propyl] ester IUPAC Name: [3-hydroxy-2-[(2-nitroimidazol-1-yl)methoxy]propyl] acetate Traditional Name: acetic acid [3-hydroxy-2-[(2-nitroimidazol-1-yl)methoxy]propyl] ester Formula: C9H13N3O6 MolecularWeight: 259.21602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CO)OCN1C=CN=C1[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCC(CO)OCN1C=CN=C1[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O6/c1-7(14)17-5-8(4-13)18-6-11-3-2-10-9(11)12(15)16/h2-3,8,13H,4-6H2,1H3