(4-nitrophenyl)methyl 3-(4-fluoranylphenoxy)-2-(2-oxidanylidene-4-prop-2-enylsulfinyl-azetidin-1-yl)-3-sulfanylidene-propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-(4-fluoranylphenoxy)-2-(2-oxidanylidene-4-prop-2-enylsulfinyl-azetidin-1-yl)-3-sulfanylidene-propanoate Openeye Name: (4-nitrophenyl)methyl 2-(2-allylsulfinyl-4-oxo-azetidin-1-yl)-3-(4-fluorophenoxy)-3-thioxo-propanoate CAS Name: 3-(4-fluorophenoxy)-2-(2-oxo-4-prop-2-enylsulfinyl-1-azetidinyl)-3-sulfanylidenepropanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(4-fluorophenoxy)-2-(2-oxo-4-prop-2-enylsulfinylazetidin-1-yl)-3-sulfanylidenepropanoate Traditional Name: 2-(2-allylsulfinyl-4-keto-azetidin-1-yl)-3-(4-fluorophenoxy)-3-thioxo-propionic acid (4-nitrobenzyl) ester Formula: C22H19FN2O7S2 MolecularWeight: 506.523863

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Descriptors Computed from Structure

Canonical SMILES:

C=CCS(=O)C1CC(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=S)OC3=CC=C(C=C3)F

Isomeric SMILES

C=CCS(=O)C1CC(=O)N1C(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=S)OC3=CC=C(C=C3)F

InChI

InChI=1S/C22H19FN2O7S2/c1-2-11-34(30)19-12-18(26)24(19)20(22(33)32-17-9-5-15(23)6-10-17)21(27)31-13-14-3-7-16(8-4-14)25(28)29/h2-10,19-20H,1,11-13H2