tert-butyl 3-ethyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)-1,2-oxazetidin-2-ium-2-carboxylate

Systemtic Name: tert-butyl 3-ethyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)-1,2-oxazetidin-2-ium-2-carboxylate Openeye Name: tert-butyl 2-(benzyloxycarbonylamino)-3-ethyl-4-oxo-oxazetidin-2-ium-2-carboxylate CAS Name: 3-ethyl-4-oxo-2-(phenylmethoxycarbonylamino)-2-oxazetidin-2-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethyl-4-oxo-2-(phenylmethoxycarbonylamino)oxazetidin-2-ium-2-carboxylate Traditional Name: 2-(benzyloxycarbonylamino)-3-ethyl-4-keto-oxazetidin-2-ium-2-carboxylic acid tert-butyl ester Formula: C17H23N2O6+ MolecularWeight: 351.37432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)O[N+]1(C(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC1C(=O)O[N+]1(C(=O)OC(C)(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O6/c1-5-13-14(20)25-19(13,16(22)24-17(2,3)4)18-15(21)23-11-12-9-7-6-8-10-12/h6-10,13H,5,11H2,1-4H3/p+1