(2-bromanyl-4-cyano-6-ethoxy-phenyl) (E)-2-phenylethenesulfonate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) (E)-2-phenylethenesulfonate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) (E)-2-phenylethenesulfonate CAS Name: (E)-2-phenylethenesulfonic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) (E)-2-phenylethenesulfonate Traditional Name: (E)-2-phenylethenesulfonic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C17H14BrNO4S MolecularWeight: 408.26636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C17H14BrNO4S/c1-2-22-16-11-14(12-19)10-15(18)17(16)23-24(20,21)9-8-13-6-4-3-5-7-13/h3-11H,2H2,1H3/b9-8+