3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]propionamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)CCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)CCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2/c28-21(12-13-22-25-23(26-29-22)20-6-2-1-3-7-20)24-16-18-8-10-19(11-9-18)17-27-14-4-5-15-27/h1-3,6-11H,4-5,12-17H2,(H,24,28)/p+1