(4-nitrophenyl)methyl 2-(2-ethylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-oxidanyl-ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(2-ethylsulfanyl-4-oxidanylidene-azetidin-1-yl)-2-oxidanyl-ethanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-ethylsulfanyl-4-oxo-azetidin-1-yl)-2-hydroxy-acetate CAS Name: 2-[2-(ethylthio)-4-oxo-1-azetidinyl]-2-hydroxyacetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2-ethylsulfanyl-4-oxoazetidin-1-yl)-2-hydroxyacetate Traditional Name: 2-[2-(ethylthio)-4-keto-azetidin-1-yl]-2-hydroxy-acetic acid (4-nitrobenzyl) ester Formula: C14H16N2O6S MolecularWeight: 340.35164

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CC(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCSC1CC(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H16N2O6S/c1-2-23-12-7-11(17)15(12)13(18)14(19)22-8-9-3-5-10(6-4-9)16(20)21/h3-6,12-13,18H,2,7-8H2,1H3