tert-butyl 2-[(3R,4R)-3-(2-hydroxyethyl)-2-oxidanylidene-1-(phenylmethyl)piperidin-4-yl]ethanoate

Systemtic Name: tert-butyl 2-[(3R,4R)-3-(2-hydroxyethyl)-2-oxidanylidene-1-(phenylmethyl)piperidin-4-yl]ethanoate Openeye Name: tert-butyl 2-[(3R,4R)-1-benzyl-3-(2-hydroxyethyl)-2-oxo-4-piperidyl]acetate CAS Name: 2-[(3R,4R)-3-(2-hydroxyethyl)-2-oxo-1-(phenylmethyl)-4-piperidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3R,4R)-1-benzyl-3-(2-hydroxyethyl)-2-oxopiperidin-4-yl]acetate Traditional Name: 2-[(3R,4R)-1-benzyl-3-(2-hydroxyethyl)-2-keto-4-piperidyl]acetic acid tert-butyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1CCN(C(=O)C1CCO)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C[C@H]1CCN(C(=O)[C@@H]1CCO)CC2=CC=CC=C2

InChI

InChI=1S/C20H29NO4/c1-20(2,3)25-18(23)13-16-9-11-21(19(24)17(16)10-12-22)14-15-7-5-4-6-8-15/h4-8,16-17,22H,9-14H2,1-3H3/t16-,17-/m1/s1