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

Systemtic Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitrophenoxy)ethanone Openeye Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitrophenoxy)ethanone CAS Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-nitrophenoxy)ethanone IUPAC Name: 1-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-(4-nitrophenoxy)ethanone Traditional Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-nitrophenoxy)ethanone Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5/c1-14-12-20(15(2)22(14)16-4-8-18(27-3)9-5-16)21(24)13-28-19-10-6-17(7-11-19)23(25)26/h4-12H,13H2,1-3H3