(4-nitrophenyl)methyl 3-(2-acetamidoethoxysulfanyl)-2-(2-ethylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-oxidanylidene-propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-(2-acetamidoethoxysulfanyl)-2-(2-ethylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-oxidanylidene-propanoate Openeye Name: (4-nitrophenyl)methyl 3-(2-acetamidoethoxysulfanyl)-2-(2-ethylsulfanyl-4-oxo-azetidin-1-yl)-3-oxo-propanoate CAS Name: 3-(2-acetamidoethoxythio)-2-[2-(ethylthio)-4-oxo-1-azetidinyl]-3-oxopropanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(2-acetamidoethoxysulfanyl)-2-(2-ethylsulfanyl-4-oxoazetidin-1-yl)-3-oxopropanoate Traditional Name: 3-(2-acetamidoethoxythio)-2-[2-(ethylthio)-4-keto-azetidin-1-yl]-3-keto-propionic acid (4-nitrobenzyl) ester Formula: C19H23N3O8S2 MolecularWeight: 485.53122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O8S2/c1-3-31-16-10-15(24)21(16)17(19(26)32-30-9-8-20-12(2)23)18(25)29-11-13-4-6-14(7-5-13)22(27)28/h4-7,16-17H,3,8-11H2,1-2H3,(H,20,23)