tert-butyl 2-[(2S,4R)-2-(hydroxymethyl)-6-oxidanylidene-piperidin-4-yl]ethanoate

Systemtic Name: tert-butyl 2-[(2S,4R)-2-(hydroxymethyl)-6-oxidanylidene-piperidin-4-yl]ethanoate Openeye Name: tert-butyl 2-[(2S,4R)-2-(hydroxymethyl)-6-oxo-4-piperidyl]acetate CAS Name: 2-[(2S,4R)-2-(hydroxymethyl)-6-oxo-4-piperidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2S,4R)-2-(hydroxymethyl)-6-oxopiperidin-4-yl]acetate Traditional Name: 2-[(4R,6S)-2-keto-6-methylol-4-piperidyl]acetic acid tert-butyl ester Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1CC(NC(=O)C1)CO

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H]1C[C@H](NC(=O)C1)CO

InChI

InChI=1S/C12H21NO4/c1-12(2,3)17-11(16)6-8-4-9(7-14)13-10(15)5-8/h8-9,14H,4-7H2,1-3H3,(H,13,15)/t8-,9+/m1/s1