phenethyl 2,5-bis(methylsulfonyloxy)pentanoate

Systemtic Name: phenethyl 2,5-bis(methylsulfonyloxy)pentanoate Openeye Name: phenethyl 2,5-bis(methylsulfonyloxy)pentanoate CAS Name: 2,5-bis(methylsulfonyloxy)pentanoic acid phenethyl ester IUPAC Name: phenethyl 2,5-bis(methylsulfonyloxy)pentanoate Traditional Name: 2,5-bis(methylsulfonyloxy)valeric acid phenethyl ester Formula: C15H22O8S2 MolecularWeight: 394.46038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O8S2/c1-24(17,18)22-11-6-9-14(23-25(2,19)20)15(16)21-12-10-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3