3-nitro-4-(2-pyridin-4-ylethylamino)benzenecarbonitrile

Systemtic Name: 3-nitro-4-(2-pyridin-4-ylethylamino)benzenecarbonitrile Openeye Name: 3-nitro-4-[2-(4-pyridyl)ethylamino]benzonitrile CAS Name: 3-nitro-4-(2-pyridin-4-ylethylamino)benzonitrile IUPAC Name: 3-nitro-4-(2-pyridin-4-ylethylamino)benzonitrile Traditional Name: 3-nitro-4-[2-(4-pyridyl)ethylamino]benzonitrile Formula: C14H12N4O2 MolecularWeight: 268.27068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCCC2=CC=NC=C2

InChI

InChI=1S/C14H12N4O2/c15-10-12-1-2-13(14(9-12)18(19)20)17-8-5-11-3-6-16-7-4-11/h1-4,6-7,9,17H,5,8H2