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

Systemtic Name: (phenylmethyl) N-methyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamate Openeye Name: benzyl N-methyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamate CAS Name: N-methyl-N-[(1S)-1-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-methyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-ylethyl]carbamate Traditional Name: N-methyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamic acid benzyl ester Formula: C21H27N2O2+ MolecularWeight: 339.45128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(C[NH+]1CCCC1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN([C@H](C[NH+]1CCCC1)C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-22(21(24)25-17-18-10-4-2-5-11-18)20(16-23-14-8-9-15-23)19-12-6-3-7-13-19/h2-7,10-13,20H,8-9,14-17H2,1H3/p+1/t20-/m1/s1