3-(4-ethylsulfonylphenyl)pentanedinitrile

Systemtic Name: 3-(4-ethylsulfonylphenyl)pentanedinitrile Openeye Name: 3-(4-ethylsulfonylphenyl)pentanedinitrile CAS Name: 3-(4-ethylsulfonylphenyl)pentanedinitrile IUPAC Name: 3-(4-ethylsulfonylphenyl)pentanedinitrile Traditional Name: 3-(4-esylphenyl)glutaronitrile Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O2S/c1-2-18(16,17)13-5-3-11(4-6-13)12(7-9-14)8-10-15/h3-6,12H,2,7-8H2,1H3