3-[(2-aminophenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile

Systemtic Name: 3-[(2-aminophenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile Openeye Name: 3-[(2-aminophenyl)methyl-(3-pyridylmethyl)amino]propanenitrile CAS Name: 3-[(2-aminophenyl)methyl-(3-pyridinylmethyl)amino]propanenitrile IUPAC Name: 3-[(2-aminophenyl)methyl-(pyridin-3-ylmethyl)amino]propanenitrile Traditional Name: 3-[(2-aminobenzyl)-(3-pyridylmethyl)amino]propionitrile Formula: C16H18N4 MolecularWeight: 266.34092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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