1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2,6-dimethylmorpholin-4-ium-4-yl)ethanone

Systemtic Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2,6-dimethylmorpholin-4-ium-4-yl)ethanone Openeye Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2,6-dimethylmorpholin-4-ium-4-yl)ethanone CAS Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(2,6-dimethyl-4-morpholin-4-iumyl)ethanone IUPAC Name: 1-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(2,6-dimethylmorpholin-4-ium-4-yl)ethanone Traditional Name: 1-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2,6-dimethylmorpholin-4-ium-4-yl)ethanone Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1C[NH+](CC(O1)C)CC(=O)C2=C(N(C(=C2)C)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H25BrN2O2/c1-13-9-19(16(4)23(13)18-7-5-17(21)6-8-18)20(24)12-22-10-14(2)25-15(3)11-22/h5-9,14-15H,10-12H2,1-4H3/p+1