3-[[3-azanylpropyl-(phenylmethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[3-azanylpropyl-(phenylmethyl)amino]methyl]benzenecarbonitrile Openeye Name: 3-[[3-aminopropyl(benzyl)amino]methyl]benzonitrile CAS Name: 3-[[3-aminopropyl-(phenylmethyl)amino]methyl]benzonitrile IUPAC Name: 3-[[3-aminopropyl(benzyl)amino]methyl]benzonitrile Traditional Name: 3-[[3-aminopropyl(benzyl)amino]methyl]benzonitrile Formula: C18H21N3 MolecularWeight: 279.37944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3/c19-10-5-11-21(14-16-6-2-1-3-7-16)15-18-9-4-8-17(12-18)13-20/h1-4,6-9,12H,5,10-11,14-15,19H2