(phenylmethyl) N-methyl-N-[(2S)-1-phenyl-3-pyrrolidin-1-ium-1-yl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-methyl-N-[(2S)-1-phenyl-3-pyrrolidin-1-ium-1-yl-propan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-benzyl-2-pyrrolidin-1-ium-1-yl-ethyl]-N-methyl-carbamate CAS Name: N-methyl-N-[(2S)-1-phenyl-3-(1-pyrrolidin-1-iumyl)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-methyl-N-[(2S)-1-phenyl-3-pyrrolidin-1-ium-1-ylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-pyrrolidin-1-ium-1-yl-ethyl]-N-methyl-carbamic acid benzyl ester Formula: C22H29N2O2+ MolecularWeight: 353.47786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)C[NH+]2CCCC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN([C@@H](CC1=CC=CC=C1)C[NH+]2CCCC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-23(22(25)26-18-20-12-6-3-7-13-20)21(17-24-14-8-9-15-24)16-19-10-4-2-5-11-19/h2-7,10-13,21H,8-9,14-18H2,1H3/p+1/t21-/m0/s1