2,2-dimethyl-1-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]propan-1-one Formula: C17H27N2O+ MolecularWeight: 275.40908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O/c1-14-5-7-15(8-6-14)13-18-9-11-19(12-10-18)16(20)17(2,3)4/h5-8H,9-13H2,1-4H3/p+1