2-[4-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-oxomethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazole-4-carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C23H31ClN5O2+ MolecularWeight: 444.97754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)N3CC[NH+](CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C23H30ClN5O2/c1-17-22(18(2)29(25-17)15-19-7-3-4-8-20(19)24)23(31)28-13-11-26(12-14-28)16-21(30)27-9-5-6-10-27/h3-4,7-8H,5-6,9-16H2,1-2H3/p+1