(2-bromanyl-4-methanoyl-6-methoxy-phenyl) 4-ethanoylbenzenesulfonate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) 4-ethanoylbenzenesulfonate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) 4-acetylbenzenesulfonate CAS Name: 4-acetylbenzenesulfonic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) 4-acetylbenzenesulfonate Traditional Name: 4-acetylbenzenesulfonic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C16H13BrO6S MolecularWeight: 413.23982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Br)C=O)OC

InChI

InChI=1S/C16H13BrO6S/c1-10(19)12-3-5-13(6-4-12)24(20,21)23-16-14(17)7-11(9-18)8-15(16)22-2/h3-9H,1-2H3