(4-nitrophenyl)methyl 3-methyl-3-oxidanyl-8-oxidanylidene-7-[2-[4-(trifluoromethyl)phenoxy]ethanoylamino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-methyl-3-oxidanyl-8-oxidanylidene-7-[2-[4-(trifluoromethyl)phenoxy]ethanoylamino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-hydroxy-3-methyl-8-oxo-7-[[2-[4-(trifluoromethyl)phenoxy]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: 3-hydroxy-3-methyl-8-oxo-7-[[1-oxo-2-[4-(trifluoromethyl)phenoxy]ethyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-hydroxy-3-methyl-8-oxo-7-[[2-[4-(trifluoromethyl)phenoxy]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: 3-hydroxy-8-keto-3-methyl-7-[[2-[4-(trifluoromethyl)phenoxy]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid (4-nitrobenzyl) ester Formula: C24H22F3N3O8S MolecularWeight: 569.50699

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2C(C(=O)N2C1C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)COC4=CC=C(C=C4)C(F)(F)F)O

Isomeric SMILES

CC1(CSC2C(C(=O)N2C1C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-])NC(=O)COC4=CC=C(C=C4)C(F)(F)F)O

InChI

InChI=1S/C24H22F3N3O8S/c1-23(34)12-39-21-18(28-17(31)11-37-16-8-4-14(5-9-16)24(25,26)27)20(32)29(21)19(23)22(33)38-10-13-2-6-15(7-3-13)30(35)36/h2-9,18-19,21,34H,10-12H2,1H3,(H,28,31)