tert-butyl (5S)-2-methoxy-5-(1-oxidanyl-3-phenyl-prop-2-ynyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (5S)-2-methoxy-5-(1-oxidanyl-3-phenyl-prop-2-ynyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-(1-hydroxy-3-phenyl-prop-2-ynyl)-5-methoxy-pyrrolidine-1-carboxylate CAS Name: (2S)-2-(1-hydroxy-3-phenylprop-2-ynyl)-5-methoxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(1-hydroxy-3-phenylprop-2-ynyl)-5-methoxypyrrolidine-1-carboxylate Traditional Name: (2S)-2-(1-hydroxy-3-phenyl-prop-2-ynyl)-5-methoxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCC1OC)C(C#CC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](CCC1OC)C(C#CC2=CC=CC=C2)O

InChI

InChI=1S/C19H25NO4/c1-19(2,3)24-18(22)20-15(11-13-17(20)23-4)16(21)12-10-14-8-6-5-7-9-14/h5-9,15-17,21H,11,13H2,1-4H3/t15-,16?,17?/m0/s1