cyclobutyl-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: cyclobutyl-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: cyclobutyl-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: cyclobutyl-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: cyclobutyl-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: cyclobutyl-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C17H25N2O+ MolecularWeight: 273.3932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3CCC3

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3CCC3

InChI

InChI=1S/C17H24N2O/c1-14-5-7-15(8-6-14)13-18-9-11-19(12-10-18)17(20)16-3-2-4-16/h5-8,16H,2-4,9-13H2,1H3/p+1