phenethyl 2,6-bis(methylsulfonyloxy)hexanoate

Systemtic Name: phenethyl 2,6-bis(methylsulfonyloxy)hexanoate Openeye Name: phenethyl 2,6-bis(methylsulfonyloxy)hexanoate CAS Name: 2,6-bis(methylsulfonyloxy)hexanoic acid phenethyl ester IUPAC Name: phenethyl 2,6-bis(methylsulfonyloxy)hexanoate Traditional Name: 2,6-bis(methylsulfonyloxy)hexanoic acid phenethyl ester Formula: C16H24O8S2 MolecularWeight: 408.48696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCCCC(C(=O)OCCC1=CC=CC=C1)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OCCCCC(C(=O)OCCC1=CC=CC=C1)OS(=O)(=O)C

InChI

InChI=1S/C16H24O8S2/c1-25(18,19)23-12-7-6-10-15(24-26(2,20)21)16(17)22-13-11-14-8-4-3-5-9-14/h3-5,8-9,15H,6-7,10-13H2,1-2H3