[(E)-2-iodanyl-1-phenyl-ethenyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-2-iodanyl-1-phenyl-ethenyl] 4-methylbenzenesulfonate Openeye Name: [(E)-2-iodo-1-phenyl-vinyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-2-iodo-1-phenylethenyl] ester IUPAC Name: [(E)-2-iodo-1-phenylethenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-2-iodo-1-phenyl-vinyl] ester Formula: C15H13IO3S MolecularWeight: 400.23139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(=CI)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/C(=C/I)/C2=CC=CC=C2

InChI

InChI=1S/C15H13IO3S/c1-12-7-9-14(10-8-12)20(17,18)19-15(11-16)13-5-3-2-4-6-13/h2-11H,1H3/b15-11+