3-[(3-aminophenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[(3-aminophenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[(3-aminophenyl)methyl-(3-pyridylmethyl)amino]propanenitrile CAS Name: 3-[(3-aminophenyl)methyl-(3-pyridinylmethyl)amino]propanenitrile IUPAC Name: 3-[(3-aminophenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile Traditional Name: 3-[(3-aminobenzyl)-(3-pyridylmethyl)amino]propionitrile Formula: C16H18N4 MolecularWeight: 266.34092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CN(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1=CC(=CC(=C1)N)CN(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C16H18N4/c17-7-3-9-20(13-15-5-2-8-19-11-15)12-14-4-1-6-16(18)10-14/h1-2,4-6,8,10-11H,3,9,12-13,18H2