(diphenylmethyl) (7E)-3-acetyloxy-7-(1-bromanyl-2-methoxy-2-oxidanylidene-ethylidene)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (7E)-3-acetyloxy-7-(1-bromanyl-2-methoxy-2-oxidanylidene-ethylidene)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl (7E)-3-acetoxy-7-(1-bromo-2-methoxy-2-oxo-ethylidene)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (7E)-3-acetyloxy-7-(1-bromo-2-methoxy-2-oxoethylidene)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (7E)-3-acetyloxy-7-(1-bromo-2-methoxy-2-oxoethylidene)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (7E)-3-acetoxy-7-(1-bromo-2-keto-2-methoxy-ethylidene)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C25H20BrNO7S MolecularWeight: 558.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(N2C(C(=C(C(=O)OC)Br)C2=O)SC1)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)OC1=C(N2C(/C(=C(\C(=O)OC)/Br)/C2=O)SC1)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H20BrNO7S/c1-14(28)33-17-13-35-23-18(19(26)24(30)32-2)22(29)27(23)20(17)25(31)34-21(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,21,23H,13H2,1-2H3/b19-18+