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

Systemtic Name: (phenylmethyl) 3-chloranyl-3-(2-hydroxyethylsulfinyl)-7-oxidanylidene-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 3-chloro-3-(2-hydroxyethylsulfinyl)-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3-chloro-3-(2-hydroxyethylsulfinyl)-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-chloro-3-(2-hydroxyethylsulfinyl)-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 3-chloro-3-(2-hydroxyethylsulfinyl)-7-keto-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C16H18ClNO5S MolecularWeight: 371.83582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClNO5S/c17-16(24(22)7-6-19)9-12-8-13(20)18(12)14(16)15(21)23-10-11-4-2-1-3-5-11/h1-5,12,14,19H,6-10H2