3-[[(E)-3-chloranylprop-2-enyl]-phenyl-amino]propanenitrile

Systemtic Name: 3-[[(E)-3-chloranylprop-2-enyl]-phenyl-amino]propanenitrile Openeye Name: 3-(N-[(E)-3-chloroallyl]anilino)propanenitrile CAS Name: 3-(N-[(E)-3-chloroprop-2-enyl]anilino)propanenitrile IUPAC Name: 3-(N-[(E)-3-chloroprop-2-enyl]anilino)propanenitrile Traditional Name: 3-(N-[(E)-3-chloroallyl]anilino)propionitrile Formula: C12H13ClN2 MolecularWeight: 220.69802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)CC=CCl

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C/C=C/Cl

InChI

InChI=1S/C12H13ClN2/c13-8-4-10-15(11-5-9-14)12-6-2-1-3-7-12/h1-4,6-8H,5,10-11H2/b8-4+