methoxymethyl 3,3-dimethyl-6-(4-nitrophenyl)sulfonyloxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: methoxymethyl 3,3-dimethyl-6-(4-nitrophenyl)sulfonyloxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: methoxymethyl 3,3-dimethyl-6-(4-nitrophenyl)sulfonyloxy-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3,3-dimethyl-6-(4-nitrophenyl)sulfonyloxy-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methoxymethyl ester IUPAC Name: methoxymethyl 3,3-dimethyl-6-(4-nitrophenyl)sulfonyloxy-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 7-keto-3,3-dimethyl-6-nosyloxy-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methoxymethyl ester Formula: C16H18N2O9S2 MolecularWeight: 446.45212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCOC)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCOC)C

InChI

InChI=1S/C16H18N2O9S2/c1-16(2)12(15(20)26-8-25-3)17-13(19)11(14(17)28-16)27-29(23,24)10-6-4-9(5-7-10)18(21)22/h4-7,11-12,14H,8H2,1-3H3