bis(phenylmethyl) 2-[(phenylmethyl)sulfinylmethyl]pentanedioate

Systemtic Name: bis(phenylmethyl) 2-[(phenylmethyl)sulfinylmethyl]pentanedioate Openeye Name: dibenzyl 2-(benzylsulfinylmethyl)pentanedioate CAS Name: 2-[(phenylmethyl)sulfinylmethyl]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-(benzylsulfinylmethyl)pentanedioate Traditional Name: 2-(benzylsulfinylmethyl)glutaric acid dibenzyl ester Formula: C27H28O5S MolecularWeight: 464.57322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(CS(=O)CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC(CS(=O)CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28O5S/c28-26(31-18-22-10-4-1-5-11-22)17-16-25(21-33(30)20-24-14-8-3-9-15-24)27(29)32-19-23-12-6-2-7-13-23/h1-15,25H,16-21H2