tert-butyl 2-[(3S)-3-azanyl-2-oxidanylidene-azocan-1-yl]ethanoate; (2R)-5-oxidanylidenepyrrolidine-2-carboxylic acid

Systemtic Name: tert-butyl 2-[(3S)-3-azanyl-2-oxidanylidene-azocan-1-yl]ethanoate; (2R)-5-oxidanylidenepyrrolidine-2-carboxylic acid Openeye Name: tert-butyl 2-[(3S)-3-amino-2-oxo-azocan-1-yl]acetate; (2R)-5-oxopyrrolidine-2-carboxylic acid CAS Name: 2-[(3S)-3-amino-2-oxo-1-azocanyl]acetic acid tert-butyl ester; (2R)-5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: tert-butyl 2-[(3S)-3-amino-2-oxoazocan-1-yl]acetate; (2R)-5-oxopyrrolidine-2-carboxylic acid Traditional Name: 2-[(3S)-3-amino-2-keto-azocan-1-yl]acetic acid tert-butyl ester; (2R)-5-ketoproline Formula: C18H31N3O6 MolecularWeight: 385.45524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCCCCC(C1=O)N.C1CC(=O)NC1C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCCCC[C@@H](C1=O)N.C1CC(=O)N[C@H]1C(=O)O

InChI

InChI=1S/C13H24N2O3.C5H7NO3/c1-13(2,3)18-11(16)9-15-8-6-4-5-7-10(14)12(15)17;7-4-2-1-3(6-4)5(8)9/h10H,4-9,14H2,1-3H3;3H,1-2H2,(H,6,7)(H,8,9)/t10-;3-/m01/s1