(3R)-3-(1,3-benzodioxol-5-yl)-3-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)propanamide

Systemtic Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)propanamide Openeye Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)propanamide CAS Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-phenyl-N-[2-(1-pyrrolidin-1-iumyl)ethyl]propanamide IUPAC Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)propanamide Traditional Name: (3R)-3-(1,3-benzodioxol-5-yl)-3-phenyl-N-(2-pyrrolidin-1-ium-1-ylethyl)propionamide Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)CC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C[C@H](C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O3/c25-22(23-10-13-24-11-4-5-12-24)15-19(17-6-2-1-3-7-17)18-8-9-20-21(14-18)27-16-26-20/h1-3,6-9,14,19H,4-5,10-13,15-16H2,(H,23,25)/p+1/t19-/m1/s1