1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-nitro-1-imidazolyl)ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-nitroimidazol-1-yl)ethanone Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2C=C(N=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4/c1-7-12(9(3)18)8(2)15-13(7)10(19)4-16-5-11(14-6-16)17(20)21/h5-6,15H,4H2,1-3H3