(E)-3-(1H-imidazol-2-yl)-1-(5-nitro-2-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(1H-imidazol-2-yl)-1-(5-nitro-2-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(2-hydroxy-5-nitro-phenyl)-3-(1H-imidazol-2-yl)prop-2-en-1-one CAS Name: (E)-1-(2-hydroxy-5-nitrophenyl)-3-(1H-imidazol-2-yl)-2-propen-1-one IUPAC Name: (E)-1-(2-hydroxy-5-nitrophenyl)-3-(1H-imidazol-2-yl)prop-2-en-1-one Traditional Name: (E)-1-(2-hydroxy-5-nitro-phenyl)-3-(1H-imidazol-2-yl)prop-2-en-1-one Formula: C12H9N3O4 MolecularWeight: 259.21756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)C=CC2=NC=CN2)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)/C=C/C2=NC=CN2)O

InChI

InChI=1S/C12H9N3O4/c16-10-2-1-8(15(18)19)7-9(10)11(17)3-4-12-13-5-6-14-12/h1-7,16H,(H,13,14)/b4-3+