2-(3,5-dimethylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(3,5-dimethylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(3,5-dimethylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(3,5-dimethylphenoxy)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(3,5-dimethylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(3,5-dimethylphenoxy)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C15H23N2O2+ MolecularWeight: 263.35532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2/c1-12-8-13(2)10-14(9-12)19-11-15(18)17-6-4-16(3)5-7-17/h8-10H,4-7,11H2,1-3H3/p+1