3-[1-(2-cyanoethylamino)ethyl]benzenecarbonitrile

Systemtic Name: 3-[1-(2-cyanoethylamino)ethyl]benzenecarbonitrile Openeye Name: 3-[1-(2-cyanoethylamino)ethyl]benzonitrile CAS Name: 3-[1-(2-cyanoethylamino)ethyl]benzonitrile IUPAC Name: 3-[1-(2-cyanoethylamino)ethyl]benzonitrile Traditional Name: 3-[1-(2-cyanoethylamino)ethyl]benzonitrile Formula: C12H13N3 MolecularWeight: 199.25172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3/c1-10(15-7-3-6-13)12-5-2-4-11(8-12)9-14/h2,4-5,8,10,15H,3,7H2,1H3