5,6-bis(4-hydroxyphenyl)octyl methanesulfonate

Systemtic Name: 5,6-bis(4-hydroxyphenyl)octyl methanesulfonate Openeye Name: 5,6-bis(4-hydroxyphenyl)octyl methanesulfonate CAS Name: methanesulfonic acid 5,6-bis(4-hydroxyphenyl)octyl ester IUPAC Name: 5,6-bis(4-hydroxyphenyl)octyl methanesulfonate Traditional Name: methanesulfonic acid 5,6-bis(4-hydroxyphenyl)octyl ester Formula: C21H28O5S MolecularWeight: 392.50902

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)O)C(CCCCOS(=O)(=O)C)C2=CC=C(C=C2)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)O)C(CCCCOS(=O)(=O)C)C2=CC=C(C=C2)O

InChI

InChI=1S/C21H28O5S/c1-3-20(16-7-11-18(22)12-8-16)21(17-9-13-19(23)14-10-17)6-4-5-15-26-27(2,24)25/h7-14,20-23H,3-6,15H2,1-2H3