[(E)-3-phenylprop-2-enyl] 4-methylsulfonylbenzoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 4-methylsulfonylbenzoate Openeye Name: [(E)-cinnamyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [(E)-cinnamyl] ester Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC=CC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OC/C=C/C2=CC=CC=C2

InChI

InChI=1S/C17H16O4S/c1-22(19,20)16-11-9-15(10-12-16)17(18)21-13-5-8-14-6-3-2-4-7-14/h2-12H,13H2,1H3/b8-5+