2-[ethyl-(2-methylphenyl)amino]-1-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 2-[ethyl-(2-methylphenyl)amino]-1-piperazin-4-ium-1-yl-ethanone Openeye Name: 2-(N-ethyl-2-methyl-anilino)-1-piperazin-4-ium-1-yl-ethanone CAS Name: 2-(N-ethyl-2-methylanilino)-1-(1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(N-ethyl-2-methylanilino)-1-piperazin-4-ium-1-ylethanone Traditional Name: 2-(N-ethyl-2-methyl-anilino)-1-piperazin-4-ium-1-yl-ethanone Formula: C15H24N3O+ MolecularWeight: 262.37056

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N1CC[NH2+]CC1)C2=CC=CC=C2C

Isomeric SMILES

CCN(CC(=O)N1CC[NH2+]CC1)C2=CC=CC=C2C

InChI

InChI=1S/C15H23N3O/c1-3-17(14-7-5-4-6-13(14)2)12-15(19)18-10-8-16-9-11-18/h4-7,16H,3,8-12H2,1-2H3/p+1