tert-butyl 2-[2-(4-nitrophenyl)carbonylsulfanyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-2-oxidanyl-ethanoate

Systemtic Name: tert-butyl 2-[2-(4-nitrophenyl)carbonylsulfanyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-2-oxidanyl-ethanoate Openeye Name: tert-butyl 2-hydroxy-2-[2-(4-nitrobenzoyl)sulfanyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate CAS Name: 2-hydroxy-2-[2-[[(4-nitrophenyl)-oxomethyl]thio]-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-hydroxy-2-[2-(4-nitrobenzoyl)sulfanyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate Traditional Name: 2-hydroxy-2-[2-keto-4-[(4-nitrobenzoyl)thio]-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetic acid tert-butyl ester Formula: C24H25N3O9S MolecularWeight: 531.535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(N1C(C(C1=O)NC(=O)COC2=CC=CC=C2)SC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)C(N1C(C(C1=O)NC(=O)COC2=CC=CC=C2)SC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C24H25N3O9S/c1-24(2,3)36-22(31)20(30)26-19(29)18(25-17(28)13-35-16-7-5-4-6-8-16)21(26)37-23(32)14-9-11-15(12-10-14)27(33)34/h4-12,18,20-21,30H,13H2,1-3H3,(H,25,28)