(phenylmethyl) 7-(4-methylphenyl)sulfonyl-6-oxidanylidene-7-azabicyclo[3.2.0]hept-3-ene-4-carboxylate

Systemtic Name: (phenylmethyl) 7-(4-methylphenyl)sulfonyl-6-oxidanylidene-7-azabicyclo[3.2.0]hept-3-ene-4-carboxylate Openeye Name: benzyl 6-oxo-7-(p-tolylsulfonyl)-7-azabicyclo[3.2.0]hept-3-ene-4-carboxylate CAS Name: 7-(4-methylphenyl)sulfonyl-6-oxo-7-azabicyclo[3.2.0]hept-3-ene-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-(4-methylphenyl)sulfonyl-6-oxo-7-azabicyclo[3.2.0]hept-3-ene-4-carboxylate Traditional Name: 6-keto-7-tosyl-7-azabicyclo[3.2.0]hept-3-ene-4-carboxylic acid benzyl ester Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3CC=C(C3C2=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3CC=C(C3C2=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H19NO5S/c1-14-7-9-16(10-8-14)28(25,26)22-18-12-11-17(19(18)20(22)23)21(24)27-13-15-5-3-2-4-6-15/h2-11,18-19H,12-13H2,1H3