(3R)-1-(2-ethylphenyl)-5-oxidanylidene-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(2-ethylphenyl)-5-oxidanylidene-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(2-ethylphenyl)-5-oxo-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide CAS Name: (3R)-1-(2-ethylphenyl)-5-oxo-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(2-ethylphenyl)-5-oxo-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrolidine-3-carboxamide Traditional Name: (3R)-1-(2-ethylphenyl)-5-keto-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]pyrrolidine-3-carboxamide Formula: C25H32N3O2+ MolecularWeight: 406.54048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

Isomeric SMILES

CCC1=CC=CC=C1N2C[C@@H](CC2=O)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

InChI

InChI=1S/C25H31N3O2/c1-2-19-9-5-6-12-23(19)28-18-22(15-24(28)29)25(30)26-16-20-10-3-4-11-21(20)17-27-13-7-8-14-27/h3-6,9-12,22H,2,7-8,13-18H2,1H3,(H,26,30)/p+1/t22-/m1/s1