2-[methyl(phenyl)amino]-1-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 2-[methyl(phenyl)amino]-1-piperazin-4-ium-1-yl-ethanone Openeye Name: 2-(N-methylanilino)-1-piperazin-4-ium-1-yl-ethanone CAS Name: 2-(N-methylanilino)-1-(1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(N-methylanilino)-1-piperazin-4-ium-1-ylethanone Traditional Name: 2-(N-methylanilino)-1-piperazin-4-ium-1-yl-ethanone Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CC[NH2+]CC1)C2=CC=CC=C2

Isomeric SMILES

CN(CC(=O)N1CC[NH2+]CC1)C2=CC=CC=C2

InChI

InChI=1S/C13H19N3O/c1-15(12-5-3-2-4-6-12)11-13(17)16-9-7-14-8-10-16/h2-6,14H,7-11H2,1H3/p+1