(phenylmethyl) 3-ethylsulfinyl-7-oxidanylidene-6-(phenylmethyl)-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 3-ethylsulfinyl-7-oxidanylidene-6-(phenylmethyl)-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 6-benzyl-3-ethylsulfinyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3-ethylsulfinyl-7-oxo-6-(phenylmethyl)-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-benzyl-3-ethylsulfinyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-benzyl-3-ethylsulfinyl-7-keto-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1CC2C(C(=O)N2C1C(=O)OCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCS(=O)C1CC2C(C(=O)N2C1C(=O)OCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25NO4S/c1-2-29(27)20-14-19-18(13-16-9-5-3-6-10-16)22(25)24(19)21(20)23(26)28-15-17-11-7-4-8-12-17/h3-12,18-21H,2,13-15H2,1H3