tert-butyl 3-[[(2-oxidanyl-1-phenyl-ethyl)amino]methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[(2-oxidanyl-1-phenyl-ethyl)amino]methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[[(2-hydroxy-1-phenyl-ethyl)amino]methyl]pyrrolidine-1-carboxylate CAS Name: 3-[[(2-hydroxy-1-phenylethyl)amino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[(2-hydroxy-1-phenylethyl)amino]methyl]pyrrolidine-1-carboxylate Traditional Name: 3-[[(2-hydroxy-1-phenyl-ethyl)amino]methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)CNC(CO)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)CNC(CO)C2=CC=CC=C2

InChI

InChI=1S/C18H28N2O3/c1-18(2,3)23-17(22)20-10-9-14(12-20)11-19-16(13-21)15-7-5-4-6-8-15/h4-8,14,16,19,21H,9-13H2,1-3H3