(4-methylphenyl)-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (4-methylphenyl)-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methanone Openeye Name: p-tolyl-[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]methanone CAS Name: (4-methylphenyl)-[4-[2-(2-pyridinyl)ethyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (4-methylphenyl)-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]methanone Traditional Name: p-tolyl-[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]methanone Formula: C19H24N3O+ MolecularWeight: 310.41336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=N3

InChI

InChI=1S/C19H23N3O/c1-16-5-7-17(8-6-16)19(23)22-14-12-21(13-15-22)11-9-18-4-2-3-10-20-18/h2-8,10H,9,11-15H2,1H3/p+1