methyl 8-oxidanylidene-3-phenyl-2-oxa-7-thia-3-azabicyclo[4.2.0]oct-4-ene-5-carboxylate

Systemtic Name: methyl 8-oxidanylidene-3-phenyl-2-oxa-7-thia-3-azabicyclo[4.2.0]oct-4-ene-5-carboxylate Openeye Name: methyl 8-oxo-3-phenyl-2-oxa-7-thia-3-azabicyclo[4.2.0]oct-4-ene-5-carboxylate CAS Name: 8-oxo-3-phenyl-2-oxa-7-thia-3-azabicyclo[4.2.0]oct-4-ene-5-carboxylic acid methyl ester IUPAC Name: methyl 8-oxo-3-phenyl-2-oxa-7-thia-3-azabicyclo[4.2.0]oct-4-ene-5-carboxylate Traditional Name: 8-keto-3-phenyl-2-oxa-7-thia-3-azabicyclo[4.2.0]oct-4-ene-5-carboxylic acid methyl ester Formula: C13H11NO4S MolecularWeight: 277.29574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(OC2C1SC2=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN(OC2C1SC2=O)C3=CC=CC=C3

InChI

InChI=1S/C13H11NO4S/c1-17-12(15)9-7-14(8-5-3-2-4-6-8)18-10-11(9)19-13(10)16/h2-7,10-11H,1H3