4-[(E)-3-(4-methylsulfonylphenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(4-methylsulfonylphenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(4-methylsulfonylphenyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-(4-methylsulfonylphenyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(4-methylsulfonylphenyl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-3-(4-mesylphenyl)prop-1-enyl]benzonitrile Formula: C17H13NO3S MolecularWeight: 311.35502

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H13NO3S/c1-22(20,21)16-9-7-15(8-10-16)17(19)11-6-13-2-4-14(12-18)5-3-13/h2-11H,1H3/b11-6+