(4-methoxyphenyl)methyl 7-azido-3-(4-methoxycarbonylphenyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 7-azido-3-(4-methoxycarbonylphenyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 7-azido-3-(4-methoxycarbonylphenyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-azido-3-(4-methoxycarbonylphenyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 7-azido-3-(4-methoxycarbonylphenyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-azido-3-(4-carbomethoxyphenyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid p-anisyl ester Formula: C23H20N4O6S MolecularWeight: 480.4931

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3N=[N+]=[N-])C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)C2=C(CSC3N2C(=O)C3N=[N+]=[N-])C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C23H20N4O6S/c1-31-16-9-3-13(4-10-16)11-33-23(30)19-17(14-5-7-15(8-6-14)22(29)32-2)12-34-21-18(25-26-24)20(28)27(19)21/h3-10,18,21H,11-12H2,1-2H3