methyl 7-azanyl-3-[(E)-3-chloranylprop-1-enyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: methyl 7-azanyl-3-[(E)-3-chloranylprop-1-enyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: methyl 7-amino-3-[(E)-3-chloroprop-1-enyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-[(E)-3-chloroprop-1-enyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl 7-amino-3-[(E)-3-chloroprop-1-enyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-3-[(E)-3-chloroprop-1-enyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester Formula: C11H13ClN2O3S MolecularWeight: 288.75052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CSC2N1C(=O)C2N)C=CCCl

Isomeric SMILES

COC(=O)C1=C(CSC2N1C(=O)C2N)/C=C/CCl

InChI

InChI=1S/C11H13ClN2O3S/c1-17-11(16)8-6(3-2-4-12)5-18-10-7(13)9(15)14(8)10/h2-3,7,10H,4-5,13H2,1H3/b3-2+