[(Z)-2-cyano-3-phenyl-prop-1-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-2-cyano-3-phenyl-prop-1-enyl] 4-methylbenzenesulfonate Openeye Name: [(Z)-2-cyano-3-phenyl-prop-1-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-2-cyano-3-phenylprop-1-enyl] ester IUPAC Name: [(Z)-2-cyano-3-phenylprop-1-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-2-cyano-3-phenyl-prop-1-enyl] ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC=C(CC2=CC=CC=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O/C=C(/CC2=CC=CC=C2)\C#N

InChI

InChI=1S/C17H15NO3S/c1-14-7-9-17(10-8-14)22(19,20)21-13-16(12-18)11-15-5-3-2-4-6-15/h2-10,13H,11H2,1H3/b16-13-