(2R)-1-(1H-imidazol-5-ylmethyl)-N-[2-(4-methoxyphenyl)phenyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[2-(4-methoxyphenyl)phenyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[2-(4-methoxyphenyl)phenyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[2-(4-methoxyphenyl)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[2-(4-methoxyphenyl)phenyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(1H-imidazol-5-ylmethyl)-N-[2-(4-methoxyphenyl)phenyl]pyrrolidin-1-ium-2-carboxamide Formula: C22H25N4O2+ MolecularWeight: 377.4595

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=CC=C2NC(=O)C3CCC[NH+]3CC4=CN=CN4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=CC=C2NC(=O)[C@H]3CCC[NH+]3CC4=CN=CN4

InChI

InChI=1S/C22H24N4O2/c1-28-18-10-8-16(9-11-18)19-5-2-3-6-20(19)25-22(27)21-7-4-12-26(21)14-17-13-23-15-24-17/h2-3,5-6,8-11,13,15,21H,4,7,12,14H2,1H3,(H,23,24)(H,25,27)/p+1/t21-/m1/s1