phenyl 2-[4-[4-[4-(2-phenoxysulfonylethoxy)phenyl]hexan-3-yl]phenoxy]ethanesulfonate

Systemtic Name: phenyl 2-[4-[4-[4-(2-phenoxysulfonylethoxy)phenyl]hexan-3-yl]phenoxy]ethanesulfonate Openeye Name: phenyl 2-[4-[1-ethyl-2-[4-(2-phenoxysulfonylethoxy)phenyl]butyl]phenoxy]ethanesulfonate CAS Name: 2-[4-[4-[4-(2-phenoxysulfonylethoxy)phenyl]hexan-3-yl]phenoxy]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[4-[4-[4-(2-phenoxysulfonylethoxy)phenyl]hexan-3-yl]phenoxy]ethanesulfonate Traditional Name: 2-[4-[1-ethyl-2-[4-(2-phenoxysulfonylethoxy)phenyl]butyl]phenoxy]ethanesulfonic acid phenyl ester Formula: C34H38O8S2 MolecularWeight: 638.79072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OCCS(=O)(=O)OC2=CC=CC=C2)C(CC)C3=CC=C(C=C3)OCCS(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CCC(C1=CC=C(C=C1)OCCS(=O)(=O)OC2=CC=CC=C2)C(CC)C3=CC=C(C=C3)OCCS(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C34H38O8S2/c1-3-33(27-15-19-29(20-16-27)39-23-25-43(35,36)41-31-11-7-5-8-12-31)34(4-2)28-17-21-30(22-18-28)40-24-26-44(37,38)42-32-13-9-6-10-14-32/h5-22,33-34H,3-4,23-26H2,1-2H3