(3-bromanyl-1-phenylmethoxy-butan-2-yl) benzenesulfonate

Systemtic Name: (3-bromanyl-1-phenylmethoxy-butan-2-yl) benzenesulfonate Openeye Name: [1-(benzyloxymethyl)-2-bromo-propyl] benzenesulfonate CAS Name: benzenesulfonic acid (3-bromo-1-phenylmethoxybutan-2-yl) ester IUPAC Name: (3-bromo-1-phenylmethoxybutan-2-yl) benzenesulfonate Traditional Name: benzenesulfonic acid [1-(benzoxymethyl)-2-bromo-propyl] ester Formula: C17H19BrO4S MolecularWeight: 399.29936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(COCC1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2)Br

Isomeric SMILES

CC(C(COCC1=CC=CC=C1)OS(=O)(=O)C2=CC=CC=C2)Br

InChI

InChI=1S/C17H19BrO4S/c1-14(18)17(13-21-12-15-8-4-2-5-9-15)22-23(19,20)16-10-6-3-7-11-16/h2-11,14,17H,12-13H2,1H3