1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone Openeye Name: 1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone CAS Name: 1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-1-imidazolyl)ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-(2-methyl-4-nitroimidazol-1-yl)ethanone Traditional Name: 1-(4-methoxyphenyl)-2-(2-methyl-4-nitro-imidazol-1-yl)ethanone Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1CC(=O)C2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1CC(=O)C2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O4/c1-9-14-13(16(18)19)8-15(9)7-12(17)10-3-5-11(20-2)6-4-10/h3-6,8H,7H2,1-2H3