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

Systemtic Name: tert-butyl 4-[(2S,3S)-3-butyl-3-ethyl-4-oxidanylidene-azetidin-2-yl]oxybenzoate Openeye Name: tert-butyl 4-[(2S,3S)-3-butyl-3-ethyl-4-oxo-azetidin-2-yl]oxybenzoate CAS Name: 4-[[(2S,3S)-3-butyl-3-ethyl-4-oxo-2-azetidinyl]oxy]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2S,3S)-3-butyl-3-ethyl-4-oxoazetidin-2-yl]oxybenzoate Traditional Name: 4-[(2S,3S)-3-butyl-3-ethyl-4-keto-azetidin-2-yl]oxybenzoic acid tert-butyl ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(NC1=O)OC2=CC=C(C=C2)C(=O)OC(C)(C)C)CC

Isomeric SMILES

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

InChI

InChI=1S/C20H29NO4/c1-6-8-13-20(7-2)17(23)21-18(20)24-15-11-9-14(10-12-15)16(22)25-19(3,4)5/h9-12,18H,6-8,13H2,1-5H3,(H,21,23)/t18-,20+/m0/s1