4-[[(3-nitrophenyl)methyl-(2-pyridin-2-ylethyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(3-nitrophenyl)methyl-(2-pyridin-2-ylethyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(3-nitrophenyl)methyl-[2-(2-pyridyl)ethyl]amino]methyl]benzonitrile CAS Name: 4-[[(3-nitrophenyl)methyl-[2-(2-pyridinyl)ethyl]amino]methyl]benzonitrile IUPAC Name: 4-[[(3-nitrophenyl)methyl-(2-pyridin-2-ylethyl)amino]methyl]benzonitrile Traditional Name: 4-[[(3-nitrobenzyl)-[2-(2-pyridyl)ethyl]amino]methyl]benzonitrile Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCN(CC2=CC=C(C=C2)C#N)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CCN(CC2=CC=C(C=C2)C#N)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O2/c23-15-18-7-9-19(10-8-18)16-25(13-11-21-5-1-2-12-24-21)17-20-4-3-6-22(14-20)26(27)28/h1-10,12,14H,11,13,16-17H2