(E)-2-(phenylsulfanylmethyl)oct-2-enenitrile

Systemtic Name: (E)-2-(phenylsulfanylmethyl)oct-2-enenitrile Openeye Name: (E)-2-(phenylsulfanylmethyl)oct-2-enenitrile CAS Name: (E)-2-[(phenylthio)methyl]-2-octenenitrile IUPAC Name: (E)-2-(phenylsulfanylmethyl)oct-2-enenitrile Traditional Name: (E)-2-[(phenylthio)methyl]oct-2-enenitrile Formula: C15H19NS MolecularWeight: 245.38306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(CSC1=CC=CC=C1)C#N

Isomeric SMILES

CCCCC/C=C(/CSC1=CC=CC=C1)\C#N

InChI

InChI=1S/C15H19NS/c1-2-3-4-6-9-14(12-16)13-17-15-10-7-5-8-11-15/h5,7-11H,2-4,6,13H2,1H3/b14-9+