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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 2-(3,4-dimethoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone CAS Name: 2-(3,4-dimethoxyphenyl)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(3,4-dimethoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 2-(3,4-dimethoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Formula: C15H23N2O3+ MolecularWeight: 279.35472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C15H22N2O3/c1-16-6-8-17(9-7-16)15(18)11-12-4-5-13(19-2)14(10-12)20-3/h4-5,10H,6-9,11H2,1-3H3/p+1