(2-bromanyl-4-methanoyl-6-methoxy-phenyl) (E)-2-phenylethenesulfonate

Systemtic Name: (2-bromanyl-4-methanoyl-6-methoxy-phenyl) (E)-2-phenylethenesulfonate Openeye Name: (2-bromo-4-formyl-6-methoxy-phenyl) (E)-2-phenylethenesulfonate CAS Name: (E)-2-phenylethenesulfonic acid (2-bromo-4-formyl-6-methoxyphenyl) ester IUPAC Name: (2-bromo-4-formyl-6-methoxyphenyl) (E)-2-phenylethenesulfonate Traditional Name: (E)-2-phenylethenesulfonic acid (2-bromo-4-formyl-6-methoxy-phenyl) ester Formula: C16H13BrO5S MolecularWeight: 397.24042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)Br)OS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)Br)OS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H13BrO5S/c1-21-15-10-13(11-18)9-14(17)16(15)22-23(19,20)8-7-12-5-3-2-4-6-12/h2-11H,1H3/b8-7+