tert-butyl (2S,3S)-2-[(4-cyclobutyl-1,4-diazepan-1-yl)carbonyl]-3-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3S)-2-[(4-cyclobutyl-1,4-diazepan-1-yl)carbonyl]-3-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,3S)-2-(4-cyclobutyl-1,4-diazepane-1-carbonyl)-3-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,3S)-2-[(4-cyclobutyl-1,4-diazepan-1-yl)-oxomethyl]-3-hydroxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-2-(4-cyclobutyl-1,4-diazepane-1-carbonyl)-3-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,3S)-2-(4-cyclobutyl-1,4-diazepane-1-carbonyl)-3-hydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H33N3O4 MolecularWeight: 367.48302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1C(=O)N2CCCN(CC2)C3CCC3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H]([C@H]1C(=O)N2CCCN(CC2)C3CCC3)O

InChI

InChI=1S/C19H33N3O4/c1-19(2,3)26-18(25)22-11-8-15(23)16(22)17(24)21-10-5-9-20(12-13-21)14-6-4-7-14/h14-16,23H,4-13H2,1-3H3/t15-,16-/m0/s1