2-[4-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[1-[(2-chlorophenyl)methyl]pyrazole-4-carbonyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-oxomethyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[1-[(2-chlorophenyl)methyl]pyrazole-4-carbonyl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[1-(2-chlorobenzyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C19H25ClN5O2+ MolecularWeight: 390.8871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C19H24ClN5O2/c1-22(2)18(26)14-23-7-9-24(10-8-23)19(27)16-11-21-25(13-16)12-15-5-3-4-6-17(15)20/h3-6,11,13H,7-10,12,14H2,1-2H3/p+1