(2R)-1-[(4-cyanophenyl)methyl]-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-[(4-cyanophenyl)methyl]-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-[(4-cyanophenyl)methyl]-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-[(4-cyanophenyl)methyl]-N-(2,4-dichlorophenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-[(4-cyanophenyl)methyl]-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(4-cyanobenzyl)-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide Formula: C19H18Cl2N3O+ MolecularWeight: 375.27172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC=C(C=C2)C#N)C(=O)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CC=C(C=C2)C#N)C(=O)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H17Cl2N3O/c20-15-7-8-17(16(21)10-15)23-19(25)18-2-1-9-24(18)12-14-5-3-13(11-22)4-6-14/h3-8,10,18H,1-2,9,12H2,(H,23,25)/p+1/t18-/m1/s1