(phenylmethyl) 3-chloranyl-7-oxidanylidene-3-(phenylsulfinyl)-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 3-chloranyl-7-oxidanylidene-3-(phenylsulfinyl)-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 3-(benzenesulfinyl)-3-chloro-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3-(benzenesulfinyl)-3-chloro-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(benzenesulfinyl)-3-chloro-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 3-(benzenesulfinyl)-3-chloro-7-keto-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C20H18ClNO4S MolecularWeight: 403.87922

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(C(N2C1=O)C(=O)OCC3=CC=CC=C3)(S(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

C1C2CC(C(N2C1=O)C(=O)OCC3=CC=CC=C3)(S(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C20H18ClNO4S/c21-20(27(25)16-9-5-2-6-10-16)12-15-11-17(23)22(15)18(20)19(24)26-13-14-7-3-1-4-8-14/h1-10,15,18H,11-13H2