2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-[2-(4-methoxyphenyl)-4-nitrophenoxy]-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-[2-(4-methoxyphenyl)-4-nitrophenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-[2-(4-methoxyphenyl)-4-nitro-phenoxy]-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22N2O5/c1-14-11-19(15(2)23(14)3)21(25)13-29-22-10-7-17(24(26)27)12-20(22)16-5-8-18(28-4)9-6-16/h5-12H,13H2,1-4H3