tert-butyl 7-azido-3-(4-methylphenyl)sulfonyloxy-8-oxidanylidene-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: tert-butyl 7-azido-3-(4-methylphenyl)sulfonyloxy-8-oxidanylidene-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: tert-butyl 7-azido-8-oxo-3-(p-tolylsulfonyloxy)-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-azido-3-(4-methylphenyl)sulfonyloxy-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-azido-3-(4-methylphenyl)sulfonyloxy-8-oxo-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-azido-8-keto-3-tosyloxy-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester Formula: C19H22N4O6S MolecularWeight: 434.46618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(N3C(CC2)C(C3=O)N=[N+]=[N-])C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(N3C(CC2)C(C3=O)N=[N+]=[N-])C(=O)OC(C)(C)C

InChI

InChI=1S/C19H22N4O6S/c1-11-5-7-12(8-6-11)30(26,27)29-14-10-9-13-15(21-22-20)17(24)23(13)16(14)18(25)28-19(2,3)4/h5-8,13,15H,9-10H2,1-4H3