tert-butyl (4S,5R)-5-(2-ethoxy-2-oxidanylidene-ethyl)-2,2-dimethyl-4-(phenylmethyl)-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4S,5R)-5-(2-ethoxy-2-oxidanylidene-ethyl)-2,2-dimethyl-4-(phenylmethyl)-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4S,5R)-4-benzyl-5-(2-ethoxy-2-oxo-ethyl)-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4S,5R)-5-(2-ethoxy-2-oxoethyl)-2,2-dimethyl-4-(phenylmethyl)-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S,5R)-4-benzyl-5-(2-ethoxy-2-oxoethyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4S,5R)-4-benzyl-5-(2-ethoxy-2-keto-ethyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(N(C(O1)(C)C)C(=O)OC(C)(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C[C@@H]1[C@@H](N(C(O1)(C)C)C(=O)OC(C)(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C21H31NO5/c1-7-25-18(23)14-17-16(13-15-11-9-8-10-12-15)22(21(5,6)26-17)19(24)27-20(2,3)4/h8-12,16-17H,7,13-14H2,1-6H3/t16-,17+/m0/s1