(phenylmethyl) (2S,3S)-3-oxidanyl-2-(2-phenylethynyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,3S)-3-oxidanyl-2-(2-phenylethynyl)pyrrolidine-1-carboxylate Openeye Name: benzyl (2S,3S)-3-hydroxy-2-(2-phenylethynyl)pyrrolidine-1-carboxylate CAS Name: (2S,3S)-3-hydroxy-2-(2-phenylethynyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S)-3-hydroxy-2-(2-phenylethynyl)pyrrolidine-1-carboxylate Traditional Name: (2S,3S)-3-hydroxy-2-(2-phenylethynyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1O)C#CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN([C@H]([C@H]1O)C#CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H19NO3/c22-19-13-14-21(18(19)12-11-16-7-3-1-4-8-16)20(23)24-15-17-9-5-2-6-10-17/h1-10,18-19,22H,13-15H2/t18-,19-/m0/s1