(phenylmethyl) 3-(2-azido-5-methyl-phenyl)sulfonyloxy-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (phenylmethyl) 3-(2-azido-5-methyl-phenyl)sulfonyloxy-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: benzyl 3-(2-azido-5-methyl-phenyl)sulfonyloxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(2-azido-5-methylphenyl)sulfonyloxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(2-azido-5-methylphenyl)sulfonyloxy-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-(2-azido-5-methyl-phenyl)sulfonyloxy-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid benzyl ester Formula: C21H18N4O6S MolecularWeight: 454.45582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=[N+]=[N-])S(=O)(=O)OC2=C(N3C(C2)CC3=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)N=[N+]=[N-])S(=O)(=O)OC2=C(N3C(C2)CC3=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O6S/c1-13-7-8-16(23-24-22)18(9-13)32(28,29)31-17-10-15-11-19(26)25(15)20(17)21(27)30-12-14-5-3-2-4-6-14/h2-9,15H,10-12H2,1H3