[4-[(Z)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 4-bromanylbenzenesulfonate

Systemtic Name: [4-[(Z)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 4-bromanylbenzenesulfonate Openeye Name: [4-[(Z)-3-oxo-3-phenyl-prop-1-enyl]phenyl] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [4-[(Z)-3-oxo-3-phenylprop-1-enyl]phenyl] ester IUPAC Name: [4-[(Z)-3-oxo-3-phenylprop-1-enyl]phenyl] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [4-[(Z)-3-keto-3-phenyl-prop-1-enyl]phenyl] ester Formula: C21H15BrO4S MolecularWeight: 443.3104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C=C\C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H15BrO4S/c22-18-9-13-20(14-10-18)27(24,25)26-19-11-6-16(7-12-19)8-15-21(23)17-4-2-1-3-5-17/h1-15H/b15-8-