(E)-3,3-dimethyl-6-phenylsulfanyloxy-hex-4-enenitrile

Systemtic Name: (E)-3,3-dimethyl-6-phenylsulfanyloxy-hex-4-enenitrile Openeye Name: (E)-3,3-dimethyl-6-phenylsulfanyloxy-hex-4-enenitrile CAS Name: benzenesulfenic acid [(E)-5-cyano-4,4-dimethylpent-2-enyl] ester IUPAC Name: (E)-3,3-dimethyl-6-phenylsulfanyloxyhex-4-enenitrile Traditional Name: (E)-3,3-dimethyl-6-(phenylthio)oxy-hex-4-enenitrile Formula: C14H17NOS MolecularWeight: 247.35588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC#N)C=CCOSC1=CC=CC=C1

Isomeric SMILES

CC(C)(CC#N)/C=C/COSC1=CC=CC=C1

InChI

InChI=1S/C14H17NOS/c1-14(2,10-11-15)9-6-12-16-17-13-7-4-3-5-8-13/h3-9H,10,12H2,1-2H3/b9-6+