ethyl 4-[3-(4-nitroimidazol-1-yl)-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethyl 4-[3-(4-nitroimidazol-1-yl)-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 4-[2-hydroxy-3-(4-nitroimidazol-1-yl)propoxy]benzoate CAS Name: 4-[2-hydroxy-3-(4-nitro-1-imidazolyl)propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-hydroxy-3-(4-nitroimidazol-1-yl)propoxy]benzoate Traditional Name: 4-[2-hydroxy-3-(4-nitroimidazol-1-yl)propoxy]benzoic acid ethyl ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CN2C=C(N=C2)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(CN2C=C(N=C2)[N+](=O)[O-])O

InChI

InChI=1S/C15H17N3O6/c1-2-23-15(20)11-3-5-13(6-4-11)24-9-12(19)7-17-8-14(16-10-17)18(21)22/h3-6,8,10,12,19H,2,7,9H2,1H3