1-[2,4-bis(fluoranyl)phenyl]-2-methyl-5-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrole-3-carboxamide

Systemtic Name: 1-[2,4-bis(fluoranyl)phenyl]-2-methyl-5-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrole-3-carboxamide Openeye Name: 1-(2,4-difluorophenyl)-2-methyl-5-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrole-3-carboxamide CAS Name: 1-(2,4-difluorophenyl)-2-methyl-5-phenyl-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyrrolecarboxamide IUPAC Name: 1-(2,4-difluorophenyl)-2-methyl-5-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrole-3-carboxamide Traditional Name: 1-(2,4-difluorophenyl)-2-methyl-5-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrrole-3-carboxamide Formula: C24H26F2N3O+ MolecularWeight: 410.479546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=C(C=C(C=C2)F)F)C3=CC=CC=C3)C(=O)NCC[NH+]4CCCC4

Isomeric SMILES

CC1=C(C=C(N1C2=C(C=C(C=C2)F)F)C3=CC=CC=C3)C(=O)NCC[NH+]4CCCC4

InChI

InChI=1S/C24H25F2N3O/c1-17-20(24(30)27-11-14-28-12-5-6-13-28)16-23(18-7-3-2-4-8-18)29(17)22-10-9-19(25)15-21(22)26/h2-4,7-10,15-16H,5-6,11-14H2,1H3,(H,27,30)/p+1