4-octylsulfonylbenzene-1,2-dicarbonitrile

Systemtic Name: 4-octylsulfonylbenzene-1,2-dicarbonitrile Openeye Name: 4-octylsulfonylphthalonitrile CAS Name: 4-octylsulfonylbenzene-1,2-dicarbonitrile IUPAC Name: 4-octylsulfonylbenzene-1,2-dicarbonitrile Traditional Name: 4-octylsulfonylphthalonitrile Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)C1=CC(=C(C=C1)C#N)C#N

Isomeric SMILES

CCCCCCCCS(=O)(=O)C1=CC(=C(C=C1)C#N)C#N

InChI

InChI=1S/C16H20N2O2S/c1-2-3-4-5-6-7-10-21(19,20)16-9-8-14(12-17)15(11-16)13-18/h8-9,11H,2-7,10H2,1H3