(phenylmethyl) (2S)-2-[[(1R,2S)-1-oxidanyl-1-phenyl-propan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[(1R,2S)-1-oxidanyl-1-phenyl-propan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)NC(=O)C2CCCN2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]([C@@H](C1=CC=CC=C1)O)NC(=O)[C@@H]2CCCN2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4/c1-16(20(25)18-11-6-3-7-12-18)23-21(26)19-13-8-14-24(19)22(27)28-15-17-9-4-2-5-10-17/h2-7,9-12,16,19-20,25H,8,13-15H2,1H3,(H,23,26)/t16-,19-,20-/m0/s1