[4-[4-bromanyl-5-methoxy-2-(methoxymethoxy)-3-oxidanyl-phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[4-bromanyl-5-methoxy-2-(methoxymethoxy)-3-oxidanyl-phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-bromo-3-hydroxy-5-methoxy-2-(methoxymethoxy)phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-bromo-3-hydroxy-5-methoxy-2-(methoxymethoxy)phenyl]phenyl] ester IUPAC Name: [4-[4-bromo-3-hydroxy-5-methoxy-2-(methoxymethoxy)phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-bromo-3-hydroxy-5-methoxy-2-(methoxymethoxy)phenyl]phenyl] ester Formula: C16H17BrO7S MolecularWeight: 433.27098

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)Br)O

Isomeric SMILES

COCOC1=C(C(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)Br)O

InChI

InChI=1S/C16H17BrO7S/c1-21-9-23-16-12(8-13(22-2)14(17)15(16)18)10-4-6-11(7-5-10)24-25(3,19)20/h4-8,18H,9H2,1-3H3