3,3-diphenyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3,3-diphenyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3,3-diphenyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3,3-diphenyl-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3,3-diphenyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3,3-diphenyl-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]propionamide Formula: C27H31N2O+ MolecularWeight: 399.54784

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N2O/c30-27(19-26(24-9-3-1-4-10-24)25-11-5-2-6-12-25)28-20-22-13-15-23(16-14-22)21-29-17-7-8-18-29/h1-6,9-16,26H,7-8,17-21H2,(H,28,30)/p+1