1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitroimidazol-1-yl)ethanone

Systemtic Name: 1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitroimidazol-1-yl)ethanone Openeye Name: 1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitroimidazol-1-yl)ethanone CAS Name: 1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-3-pyrrolyl]-2-(4-nitro-1-imidazolyl)ethanone IUPAC Name: 1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-(4-nitroimidazol-1-yl)ethanone Traditional Name: 1-[1-[2-(4-methoxyphenyl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitroimidazol-1-yl)ethanone Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=C(C=C2)OC)C)C(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=C(C=C2)OC)C)C(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4/c1-14-10-18(19(25)11-22-12-20(21-13-22)24(26)27)15(2)23(14)9-8-16-4-6-17(28-3)7-5-16/h4-7,10,12-13H,8-9,11H2,1-3H3