tert-butyl (2R)-2-[(4-phenylbutanoylamino)methyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[(4-phenylbutanoylamino)methyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[(4-phenylbutanoylamino)methyl]pyrrolidine-1-carboxylate CAS Name: (2R)-2-[[(1-oxo-4-phenylbutyl)amino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(4-phenylbutanoylamino)methyl]pyrrolidine-1-carboxylate Traditional Name: (2R)-2-[(4-phenylbutanoylamino)methyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1CNC(=O)CCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C20H30N2O3/c1-20(2,3)25-19(24)22-14-8-12-17(22)15-21-18(23)13-7-11-16-9-5-4-6-10-16/h4-6,9-10,17H,7-8,11-15H2,1-3H3,(H,21,23)/t17-/m1/s1