tert-butyl N-[3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamate CAS Name: N-[3-[oxo-[[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]amino]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]carbamoyl]phenyl]carbamate Traditional Name: N-[3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NC[C@@H](C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C24H31N3O3/c1-24(2,3)30-23(29)26-20-13-9-12-19(16-20)22(28)25-17-21(27-14-7-8-15-27)18-10-5-4-6-11-18/h4-6,9-13,16,21H,7-8,14-15,17H2,1-3H3,(H,25,28)(H,26,29)/p+1/t21-/m0/s1