methyl 3-chloranyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: methyl 3-chloro-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-chloro-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-chloro-8-keto-7-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester Formula: C9H10ClNO4S MolecularWeight: 263.698

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2N(C1=O)C(=C(CS2)Cl)C(=O)OC

Isomeric SMILES

COC1C2N(C1=O)C(=C(CS2)Cl)C(=O)OC

InChI

InChI=1S/C9H10ClNO4S/c1-14-6-7(12)11-5(9(13)15-2)4(10)3-16-8(6)11/h6,8H,3H2,1-2H3