2-(3-methylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(3-methylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(m-tolyl)ethanone CAS Name: 2-(3-methylphenyl)-1-(4-methyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(3-methylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)ethanone Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(m-tolyl)ethanone Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O/c1-12-4-3-5-13(10-12)11-14(17)16-8-6-15(2)7-9-16/h3-5,10H,6-9,11H2,1-2H3/p+1