2-[4-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C20H30N5O+ MolecularWeight: 356.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)CN3CC[NH+](CC3)CC(=O)N(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)CN3CC[NH+](CC3)CC(=O)N(C)C)C

InChI

InChI=1S/C20H29N5O/c1-15-5-6-17(11-16(15)2)20-18(12-21-22-20)13-24-7-9-25(10-8-24)14-19(26)23(3)4/h5-6,11-12H,7-10,13-14H2,1-4H3,(H,21,22)/p+1