3-[3-oxidanylidenebutyl-(phenylmethyl)amino]propanenitrile

Systemtic Name: 3-[3-oxidanylidenebutyl-(phenylmethyl)amino]propanenitrile Openeye Name: 3-[benzyl(3-oxobutyl)amino]propanenitrile CAS Name: 3-[3-oxobutyl-(phenylmethyl)amino]propanenitrile IUPAC Name: 3-[benzyl(3-oxobutyl)amino]propanenitrile Traditional Name: 3-[benzyl(3-ketobutyl)amino]propionitrile Formula: C14H18N2O MolecularWeight: 230.30552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN(CCC#N)CC1=CC=CC=C1

Isomeric SMILES

CC(=O)CCN(CCC#N)CC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O/c1-13(17)8-11-16(10-5-9-15)12-14-6-3-2-4-7-14/h2-4,6-7H,5,8,10-12H2,1H3