(4-nitrophenyl)methyl 3,3-bis(ethanoylsulfanyl)-2-(3-ethyl-2-oxidanylidene-4-prop-2-enylsulfinyl-azetidin-1-yl)prop-2-enoate

Systemtic Name: (4-nitrophenyl)methyl 3,3-bis(ethanoylsulfanyl)-2-(3-ethyl-2-oxidanylidene-4-prop-2-enylsulfinyl-azetidin-1-yl)prop-2-enoate Openeye Name: (4-nitrophenyl)methyl 3,3-bis(acetylsulfanyl)-2-(2-allylsulfinyl-3-ethyl-4-oxo-azetidin-1-yl)prop-2-enoate CAS Name: 3,3-bis(acetylthio)-2-(3-ethyl-2-oxo-4-prop-2-enylsulfinyl-1-azetidinyl)-2-propenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3,3-bis(acetylsulfanyl)-2-(3-ethyl-2-oxo-4-prop-2-enylsulfinylazetidin-1-yl)prop-2-enoate Traditional Name: 3,3-bis(acetylthio)-2-(2-allylsulfinyl-3-ethyl-4-keto-azetidin-1-yl)acrylic acid (4-nitrobenzyl) ester Formula: C22H24N2O8S3 MolecularWeight: 540.62956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(N(C1=O)C(=C(SC(=O)C)SC(=O)C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)CC=C

Isomeric SMILES

CCC1C(N(C1=O)C(=C(SC(=O)C)SC(=O)C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)CC=C

InChI

InChI=1S/C22H24N2O8S3/c1-5-11-35(31)20-17(6-2)19(27)23(20)18(22(33-13(3)25)34-14(4)26)21(28)32-12-15-7-9-16(10-8-15)24(29)30/h5,7-10,17,20H,1,6,11-12H2,2-4H3