[3-(7-bromanyl-2,3-dimethyl-3H-1-benzofuran-2-yl)-5-methylsulfonyloxy-pentyl] methanesulfonate

Systemtic Name: [3-(7-bromanyl-2,3-dimethyl-3H-1-benzofuran-2-yl)-5-methylsulfonyloxy-pentyl] methanesulfonate Openeye Name: [3-(7-bromo-2,3-dimethyl-3H-benzofuran-2-yl)-5-methylsulfonyloxy-pentyl] methanesulfonate CAS Name: methanesulfonic acid [3-(7-bromo-2,3-dimethyl-3H-benzofuran-2-yl)-5-methylsulfonyloxypentyl] ester IUPAC Name: [3-(7-bromo-2,3-dimethyl-3H-1-benzofuran-2-yl)-5-methylsulfonyloxypentyl] methanesulfonate Traditional Name: methanesulfonic acid [3-(7-bromo-2,3-dimethyl-coumaran-2-yl)-5-methylsulfonyloxy-pentyl] ester Formula: C17H25BrO7S2 MolecularWeight: 485.4102

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C(=CC=C2)Br)OC1(C)C(CCOS(=O)(=O)C)CCOS(=O)(=O)C

Isomeric SMILES

CC1C2=C(C(=CC=C2)Br)OC1(C)C(CCOS(=O)(=O)C)CCOS(=O)(=O)C

InChI

InChI=1S/C17H25BrO7S2/c1-12-14-6-5-7-15(18)16(14)25-17(12,2)13(8-10-23-26(3,19)20)9-11-24-27(4,21)22/h5-7,12-13H,8-11H2,1-4H3