[4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 6-bromanylhexanoate

Systemtic Name: [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 6-bromanylhexanoate Openeye Name: [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 6-bromohexanoate CAS Name: 6-bromohexanoic acid [4-[4-(2-thiiranylmethylsulfonyl)phenoxy]phenyl] ester IUPAC Name: [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] 6-bromohexanoate Traditional Name: 6-bromohexanoic acid [4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl] ester Formula: C21H23BrO5S2 MolecularWeight: 499.43832

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Descriptors Computed from Structure

Canonical SMILES:

C1C(S1)CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(=O)CCCCCBr

Isomeric SMILES

C1C(S1)CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)OC(=O)CCCCCBr

InChI

InChI=1S/C21H23BrO5S2/c22-13-3-1-2-4-21(23)27-18-7-5-16(6-8-18)26-17-9-11-20(12-10-17)29(24,25)15-19-14-28-19/h5-12,19H,1-4,13-15H2