3-[3,4-dihydro-2H-chromen-2-ylmethyl-(phenylmethyl)amino]propanenitrile

Systemtic Name: 3-[3,4-dihydro-2H-chromen-2-ylmethyl-(phenylmethyl)amino]propanenitrile Openeye Name: 3-[benzyl(chroman-2-ylmethyl)amino]propanenitrile CAS Name: 3-[3,4-dihydro-2H-1-benzopyran-2-ylmethyl-(phenylmethyl)amino]propanenitrile IUPAC Name: 3-[benzyl(3,4-dihydro-2H-chromen-2-ylmethyl)amino]propanenitrile Traditional Name: 3-[benzyl(chroman-2-ylmethyl)amino]propionitrile Formula: C20H22N2O MolecularWeight: 306.40148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2OC1CN(CCC#N)CC3=CC=CC=C3

Isomeric SMILES

C1CC2=CC=CC=C2OC1CN(CCC#N)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O/c21-13-6-14-22(15-17-7-2-1-3-8-17)16-19-12-11-18-9-4-5-10-20(18)23-19/h1-5,7-10,19H,6,11-12,14-16H2