2-imidazol-1-yl-1-[3-nitro-4,5-bis(oxidanyl)phenyl]ethanone hydrochloride

Systemtic Name: 2-imidazol-1-yl-1-[3-nitro-4,5-bis(oxidanyl)phenyl]ethanone hydrochloride Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-imidazol-1-yl-ethanone hydrochloride CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-(1-imidazolyl)ethanone hydrochloride IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-2-imidazol-1-ylethanone hydrochloride Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-2-imidazol-1-yl-ethanone hydrochloride Formula: C11H10ClN3O5 MolecularWeight: 299.6672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CN(C=N1)CC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-].Cl

InChI

InChI=1S/C11H9N3O5.ClH/c15-9-4-7(3-8(11(9)17)14(18)19)10(16)5-13-2-1-12-6-13;/h1-4,6,15,17H,5H2;1H