5-(4-chlorophenyl)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1H-pyrazole-4-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1H-pyrazole-4-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-1H-pyrazole-4-carboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-1H-pyrazole-4-carboxamide Formula: C23H26ClN4O2+ MolecularWeight: 425.93114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)Cl)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](CNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)Cl)[NH+]4CCCC4

InChI

InChI=1S/C23H25ClN4O2/c1-30-19-6-4-5-17(13-19)21(28-11-2-3-12-28)15-25-23(29)20-14-26-27-22(20)16-7-9-18(24)10-8-16/h4-10,13-14,21H,2-3,11-12,15H2,1H3,(H,25,29)(H,26,27)/p+1/t21-/m0/s1