2-piperazin-1-ium-1-yl-1-(2,3,5,6-tetramethylphenyl)ethanone

Systemtic Name: 2-piperazin-1-ium-1-yl-1-(2,3,5,6-tetramethylphenyl)ethanone Openeye Name: 2-piperazin-1-ium-1-yl-1-(2,3,5,6-tetramethylphenyl)ethanone CAS Name: 2-(1-piperazin-1-iumyl)-1-(2,3,5,6-tetramethylphenyl)ethanone IUPAC Name: 2-piperazin-1-ium-1-yl-1-(2,3,5,6-tetramethylphenyl)ethanone Traditional Name: 2-piperazin-1-ium-1-yl-1-(2,3,5,6-tetramethylphenyl)ethanone Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)C[NH+]2CCNCC2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)C[NH+]2CCNCC2)C)C

InChI

InChI=1S/C16H24N2O/c1-11-9-12(2)14(4)16(13(11)3)15(19)10-18-7-5-17-6-8-18/h9,17H,5-8,10H2,1-4H3/p+1