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

Systemtic Name: (4-methoxyphenyl)methyl 7-azido-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 7-azido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-azido-3-methyl-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-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-azido-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid p-anisyl ester Formula: C16H16N4O4S MolecularWeight: 360.38764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)N=[N+]=[N-])SC1)C(=O)OCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(N2C(C(C2=O)N=[N+]=[N-])SC1)C(=O)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C16H16N4O4S/c1-9-8-25-15-12(18-19-17)14(21)20(15)13(9)16(22)24-7-10-3-5-11(23-2)6-4-10/h3-6,12,15H,7-8H2,1-2H3