2-[4-(3-bromanylphenoxy)phenoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[4-(3-bromanylphenoxy)phenoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-(3-bromophenoxy)phenoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[4-(3-bromophenoxy)phenoxy]ethyl ester IUPAC Name: 2-[4-(3-bromophenoxy)phenoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[4-(3-bromophenoxy)phenoxy]ethyl ester Formula: C21H19BrO5S MolecularWeight: 463.34156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)OC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H19BrO5S/c1-16-5-11-21(12-6-16)28(23,24)26-14-13-25-18-7-9-19(10-8-18)27-20-4-2-3-17(22)15-20/h2-12,15H,13-14H2,1H3