(3-methoxycarbonylphenyl)methyl 7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (3-methoxycarbonylphenyl)methyl 7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: (3-methoxycarbonylphenyl)methyl 7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (3-methoxycarbonylphenyl)methyl ester IUPAC Name: (3-methoxycarbonylphenyl)methyl 7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (3-carbomethoxybenzyl) ester Formula: C15H13NO5S MolecularWeight: 319.33242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CSC3N2C(=O)C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CSC3N2C(=O)C3

InChI

InChI=1S/C15H13NO5S/c1-20-14(18)10-4-2-3-9(5-10)7-21-15(19)11-8-22-13-6-12(17)16(11)13/h2-5,8,13H,6-7H2,1H3