2-(2,6-dimethylphenoxy)-1-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(2,6-dimethylphenoxy)-1-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(2,6-dimethylphenoxy)-1-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 2-(2,6-dimethylphenoxy)-1-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(2,6-dimethylphenoxy)-1-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(2,6-dimethylphenoxy)-1-(4-p-anisylpiperazin-4-ium-1-yl)ethanone Formula: C22H29N2O3+ MolecularWeight: 369.47726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3/c1-17-5-4-6-18(2)22(17)27-16-21(25)24-13-11-23(12-14-24)15-19-7-9-20(26-3)10-8-19/h4-10H,11-16H2,1-3H3/p+1