ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)-3,3-diethyl-4-oxidanylidene-azetidin-1-yl]-2-oxidanyl-ethanoate

Systemtic Name: ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)-3,3-diethyl-4-oxidanylidene-azetidin-1-yl]-2-oxidanyl-ethanoate Openeye Name: ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)-3,3-diethyl-4-oxo-azetidin-1-yl]-2-hydroxy-acetate CAS Name: 2-[2-(1,3-benzoxazol-2-ylthio)-3,3-diethyl-4-oxo-1-azetidinyl]-2-hydroxyacetic acid ethyl ester IUPAC Name: ethyl 2-[2-(1,3-benzoxazol-2-ylsulfanyl)-3,3-diethyl-4-oxoazetidin-1-yl]-2-hydroxyacetate Traditional Name: 2-[2-(1,3-benzoxazol-2-ylthio)-3,3-diethyl-4-keto-azetidin-1-yl]-2-hydroxy-acetic acid ethyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(C(=O)OCC)O)SC2=NC3=CC=CC=C3O2)CC

Isomeric SMILES

CCC1(C(N(C1=O)C(C(=O)OCC)O)SC2=NC3=CC=CC=C3O2)CC

InChI

InChI=1S/C18H22N2O5S/c1-4-18(5-2)15(23)20(13(21)14(22)24-6-3)16(18)26-17-19-11-9-7-8-10-12(11)25-17/h7-10,13,16,21H,4-6H2,1-3H3