tert-butyl 4-[(2S,3S)-3-ethyl-4-oxidanylidene-3-(phenylmethyl)azetidin-2-yl]oxybenzoate

Systemtic Name: tert-butyl 4-[(2S,3S)-3-ethyl-4-oxidanylidene-3-(phenylmethyl)azetidin-2-yl]oxybenzoate Openeye Name: tert-butyl 4-[(2S,3S)-3-benzyl-3-ethyl-4-oxo-azetidin-2-yl]oxybenzoate CAS Name: 4-[[(2S,3S)-3-ethyl-4-oxo-3-(phenylmethyl)-2-azetidinyl]oxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S,3S)-3-benzyl-3-ethyl-4-oxoazetidin-2-yl]oxybenzoate Traditional Name: 4-[(2S,3S)-3-benzyl-3-ethyl-4-keto-azetidin-2-yl]oxybenzoic acid tert-butyl ester Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(NC1=O)OC2=CC=C(C=C2)C(=O)OC(C)(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC[C@@]1([C@@H](NC1=O)OC2=CC=C(C=C2)C(=O)OC(C)(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C23H27NO4/c1-5-23(15-16-9-7-6-8-10-16)20(26)24-21(23)27-18-13-11-17(12-14-18)19(25)28-22(2,3)4/h6-14,21H,5,15H2,1-4H3,(H,24,26)/t21-,23+/m0/s1