tert-butyl (2S)-2-[(12S)-12-oxidanyltridecyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(12S)-12-oxidanyltridecyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(12S)-12-hydroxytridecyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(12S)-12-hydroxytridecyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(12S)-12-hydroxytridecyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(12S)-12-hydroxytridecyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H43NO3 MolecularWeight: 369.58172

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCCC1CCCN1C(=O)OC(C)(C)C)O

Isomeric SMILES

C[C@@H](CCCCCCCCCCC[C@H]1CCCN1C(=O)OC(C)(C)C)O

InChI

InChI=1S/C22H43NO3/c1-19(24)15-12-10-8-6-5-7-9-11-13-16-20-17-14-18-23(20)21(25)26-22(2,3)4/h19-20,24H,5-18H2,1-4H3/t19-,20-/m0/s1