(phenylmethyl) 7-oxidanylidene-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (phenylmethyl) 7-oxidanylidene-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: benzyl 7-oxo-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 7-oxo-3-(phenylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-oxo-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-3-(phenylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid benzyl ester Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(=O)N2C(=C1SC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C2CC(=O)N2C(=C1SC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H17NO3S/c22-18-12-15-11-17(25-16-9-5-2-6-10-16)19(21(15)18)20(23)24-13-14-7-3-1-4-8-14/h1-10,15H,11-13H2