N,N-dimethyl-2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-dimethyl-2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-dimethyl-2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-dimethyl-2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-dimethyl-2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-dimethyl-2-[4-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]acetamide Formula: C24H30N5O+ MolecularWeight: 404.5279

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5O/c1-27(2)23(30)18-29-14-12-28(13-15-29)17-22-16-25-26-24(22)21-10-8-20(9-11-21)19-6-4-3-5-7-19/h3-11,16H,12-15,17-18H2,1-2H3,(H,25,26)/p+1