3-[[3-azanylpropyl(pyridin-3-ylmethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-azanylpropyl(pyridin-3-ylmethyl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[[3-aminopropyl(3-pyridylmethyl)amino]methyl]benzonitrile CAS Name: 3-[[3-aminopropyl(3-pyridinylmethyl)amino]methyl]benzonitrile IUPAC Name: 3-[[3-aminopropyl(pyridin-3-ylmethyl)amino]methyl]benzonitrile Traditional Name: 3-[[3-aminopropyl(3-pyridylmethyl)amino]methyl]benzonitrile Formula: C17H20N4 MolecularWeight: 280.3675

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4/c18-7-3-9-21(14-17-6-2-8-20-12-17)13-16-5-1-4-15(10-16)11-19/h1-2,4-6,8,10,12H,3,7,9,13-14,18H2