1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-ethylpyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-ethylpyridin-1-ium-1-yl)ethanone Openeye Name: 1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-pyrrol-3-yl]-2-(4-ethylpyridin-1-ium-1-yl)ethanone CAS Name: 1-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]-2-(4-ethyl-1-pyridin-1-iumyl)ethanone IUPAC Name: 1-[1-[(2-chlorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-(4-ethylpyridin-1-ium-1-yl)ethanone Traditional Name: 1-[1-(2-chlorobenzyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-ethylpyridin-1-ium-1-yl)ethanone Formula: C22H24ClN2O+ MolecularWeight: 367.89176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)CC3=CC=CC=C3Cl)C

Isomeric SMILES

CCC1=CC=[N+](C=C1)CC(=O)C2=C(N(C(=C2)C)CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C22H24ClN2O/c1-4-18-9-11-24(12-10-18)15-22(26)20-13-16(2)25(17(20)3)14-19-7-5-6-8-21(19)23/h5-13H,4,14-15H2,1-3H3/q+1