3-[2-isocyanoethyl-(phenylmethyl)amino]propanenitrile

Systemtic Name: 3-[2-isocyanoethyl-(phenylmethyl)amino]propanenitrile Openeye Name: 3-[benzyl(2-isocyanoethyl)amino]propanenitrile CAS Name: 3-[2-isocyanoethyl-(phenylmethyl)amino]propanenitrile IUPAC Name: 3-[benzyl(2-isocyanoethyl)amino]propanenitrile Traditional Name: 3-[benzyl(2-isocyanoethyl)amino]propionitrile Formula: C13H15N3 MolecularWeight: 213.2783

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]CCN(CCC#N)CC1=CC=CC=C1

Isomeric SMILES

[C-]#[N+]CCN(CCC#N)CC1=CC=CC=C1

InChI

InChI=1S/C13H15N3/c1-15-9-11-16(10-5-8-14)12-13-6-3-2-4-7-13/h2-4,6-7H,5,9-12H2