(2R)-N-[2-(4-methoxyphenyl)phenyl]-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-[2-(4-methoxyphenyl)phenyl]-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-[2-(4-methoxyphenyl)phenyl]-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[2-(4-methoxyphenyl)phenyl]-1-[(1-methyl-4-pyrazolyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-[2-(4-methoxyphenyl)phenyl]-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-[2-(4-methoxyphenyl)phenyl]-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-ium-2-carboxamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+]2CCCC2C(=O)NC3=CC=CC=C3C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C=C(C=N1)C[NH+]2CCC[C@@H]2C(=O)NC3=CC=CC=C3C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H26N4O2/c1-26-15-17(14-24-26)16-27-13-5-8-22(27)23(28)25-21-7-4-3-6-20(21)18-9-11-19(29-2)12-10-18/h3-4,6-7,9-12,14-15,22H,5,8,13,16H2,1-2H3,(H,25,28)/p+1/t22-/m1/s1