(phenylmethyl) 3-deuterio-7-oxidanylidene-5-oxa-8-thia-4-azabicyclo[4.2.0]oct-2-ene-4-carboxylate

Systemtic Name: (phenylmethyl) 3-deuterio-7-oxidanylidene-5-oxa-8-thia-4-azabicyclo[4.2.0]oct-2-ene-4-carboxylate Openeye Name: benzyl 3-deuterio-7-oxo-5-oxa-8-thia-4-azabicyclo[4.2.0]oct-2-ene-4-carboxylate CAS Name: 3-deuterio-7-oxo-5-oxa-8-thia-4-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-deuterio-7-oxo-5-oxa-8-thia-4-azabicyclo[4.2.0]oct-2-ene-4-carboxylate Traditional Name: 3-deuterio-7-keto-5-oxa-8-thia-4-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid benzyl ester Formula: C13H11NO4S MolecularWeight: 278.301902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C=CC3C(O2)C(=O)S3

Isomeric SMILES

[2H]C1=CC2C(C(=O)S2)ON1C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C13H11NO4S/c15-12-11-10(19-12)6-7-14(18-11)13(16)17-8-9-4-2-1-3-5-9/h1-7,10-11H,8H2/i7D