N-cyclopropyl-2-[4-[5-ethyl-1-(4-methylphenyl)pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[5-ethyl-1-(4-methylphenyl)pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[5-ethyl-1-(p-tolyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[5-ethyl-1-(4-methylphenyl)-4-pyrazolyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[5-ethyl-1-(4-methylphenyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[5-ethyl-1-(p-tolyl)pyrazole-4-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C22H30N5O2+ MolecularWeight: 396.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)C)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)C)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C22H29N5O2/c1-3-20-19(14-23-27(20)18-8-4-16(2)5-9-18)22(29)26-12-10-25(11-13-26)15-21(28)24-17-6-7-17/h4-5,8-9,14,17H,3,6-7,10-13,15H2,1-2H3,(H,24,28)/p+1