methyl 7-methoxy-3-(4-methylphenyl)sulfonyloxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: methyl 7-methoxy-3-(4-methylphenyl)sulfonyloxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: methyl 7-methoxy-8-oxo-3-(p-tolylsulfonyloxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-methoxy-3-(4-methylphenyl)sulfonyloxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl 7-methoxy-3-(4-methylphenyl)sulfonyloxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-methoxy-3-tosyloxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester Formula: C16H17NO7S2 MolecularWeight: 399.43868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(N3C(C(C3=O)OC)SC2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(N3C(C(C3=O)OC)SC2)C(=O)OC

InChI

InChI=1S/C16H17NO7S2/c1-9-4-6-10(7-5-9)26(20,21)24-11-8-25-15-13(22-2)14(18)17(15)12(11)16(19)23-3/h4-7,13,15H,8H2,1-3H3