methyl 3-methyl-2-[2-methylsulfanyl-3-[2-[(4-nitrophenyl)methoxycarbonyloxy]propan-2-yl]-4-oxidanylidene-azetidin-1-yl]but-2-enoate

Systemtic Name: methyl 3-methyl-2-[2-methylsulfanyl-3-[2-[(4-nitrophenyl)methoxycarbonyloxy]propan-2-yl]-4-oxidanylidene-azetidin-1-yl]but-2-enoate Openeye Name: methyl 3-methyl-2-[3-[1-methyl-1-[(4-nitrophenyl)methoxycarbonyloxy]ethyl]-2-methylsulfanyl-4-oxo-azetidin-1-yl]but-2-enoate CAS Name: 3-methyl-2-[2-(methylthio)-3-[2-[(4-nitrophenyl)methoxy-oxomethoxy]propan-2-yl]-4-oxo-1-azetidinyl]-2-butenoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[2-methylsulfanyl-3-[2-[(4-nitrophenyl)methoxycarbonyloxy]propan-2-yl]-4-oxoazetidin-1-yl]but-2-enoate Traditional Name: 2-[2-keto-3-[1-methyl-1-(4-nitrobenzyl)oxycarbonyloxy-ethyl]-4-(methylthio)azetidin-1-yl]-3-methyl-but-2-enoic acid methyl ester Formula: C21H26N2O8S MolecularWeight: 466.50474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC)N1C(C(C1=O)C(C)(C)OC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC)C

Isomeric SMILES

CC(=C(C(=O)OC)N1C(C(C1=O)C(C)(C)OC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])SC)C

InChI

InChI=1S/C21H26N2O8S/c1-12(2)16(19(25)29-5)22-17(24)15(18(22)32-6)21(3,4)31-20(26)30-11-13-7-9-14(10-8-13)23(27)28/h7-10,15,18H,11H2,1-6H3