3-[2-oxidanylpropyl(phenyl)amino]propanenitrile

Systemtic Name: 3-[2-oxidanylpropyl(phenyl)amino]propanenitrile Openeye Name: 3-[N-(2-hydroxypropyl)anilino]propanenitrile CAS Name: 3-[N-(2-hydroxypropyl)anilino]propanenitrile IUPAC Name: 3-[N-(2-hydroxypropyl)anilino]propanenitrile Traditional Name: 3-[N-(2-hydroxypropyl)anilino]propionitrile Formula: C12H16N2O MolecularWeight: 204.26824

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CCC#N)C1=CC=CC=C1)O

Isomeric SMILES

CC(CN(CCC#N)C1=CC=CC=C1)O

InChI

InChI=1S/C12H16N2O/c1-11(15)10-14(9-5-8-13)12-6-3-2-4-7-12/h2-4,6-7,11,15H,5,9-10H2,1H3