(2R)-1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-[[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]methyl]-N,N-dimethyl-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-[[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]methyl]-N,N-dimethylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-[[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]methyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Formula: C23H26ClN4O+ MolecularWeight: 409.93174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCC[NH+]1CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CN(C)C(=O)[C@H]1CCC[NH+]1CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H25ClN4O/c1-26(2)23(29)21-9-6-14-27(21)15-18-16-28(20-7-4-3-5-8-20)25-22(18)17-10-12-19(24)13-11-17/h3-5,7-8,10-13,16,21H,6,9,14-15H2,1-2H3/p+1/t21-/m1/s1