tert-butyl (2S,5S)-2-(oxan-2-yloxymethyl)-5-(phenylmethoxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,5S)-2-(oxan-2-yloxymethyl)-5-(phenylmethoxymethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,5S)-2-(benzyloxymethyl)-5-(tetrahydropyran-2-yloxymethyl)pyrrolidine-1-carboxylate CAS Name: (2S,5S)-2-(2-oxanyloxymethyl)-5-(phenylmethoxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,5S)-2-(oxan-2-yloxymethyl)-5-(phenylmethoxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2S,5S)-2-(benzoxymethyl)-5-(tetrahydropyran-2-yloxymethyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H35NO5 MolecularWeight: 405.5277

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CCC1COC2CCCCO2)COCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](CC[C@H]1COC2CCCCO2)COCC3=CC=CC=C3

InChI

InChI=1S/C23H35NO5/c1-23(2,3)29-22(25)24-19(16-26-15-18-9-5-4-6-10-18)12-13-20(24)17-28-21-11-7-8-14-27-21/h4-6,9-10,19-21H,7-8,11-17H2,1-3H3/t19-,20-,21?/m0/s1