(2-methoxy-2,2-diphenyl-ethyl) 4-bromanylbenzenesulfonate

Systemtic Name: (2-methoxy-2,2-diphenyl-ethyl) 4-bromanylbenzenesulfonate Openeye Name: (2-methoxy-2,2-diphenyl-ethyl) 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid (2-methoxy-2,2-diphenylethyl) ester IUPAC Name: (2-methoxy-2,2-diphenylethyl) 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid (2-methoxy-2,2-diphenyl-ethyl) ester Formula: C21H19BrO4S MolecularWeight: 447.34216

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Descriptors Computed from Structure

Canonical SMILES:

COC(COS(=O)(=O)C1=CC=C(C=C1)Br)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(COS(=O)(=O)C1=CC=C(C=C1)Br)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H19BrO4S/c1-25-21(17-8-4-2-5-9-17,18-10-6-3-7-11-18)16-26-27(23,24)20-14-12-19(22)13-15-20/h2-15H,16H2,1H3