2-(6-chloranyl-3-nitro-pyridin-2-yl)-2-(4-hexylphenyl)ethanenitrile

Systemtic Name: 2-(6-chloranyl-3-nitro-pyridin-2-yl)-2-(4-hexylphenyl)ethanenitrile Openeye Name: 2-(6-chloro-3-nitro-2-pyridyl)-2-(4-hexylphenyl)acetonitrile CAS Name: 2-(6-chloro-3-nitro-2-pyridinyl)-2-(4-hexylphenyl)acetonitrile IUPAC Name: 2-(6-chloro-3-nitropyridin-2-yl)-2-(4-hexylphenyl)acetonitrile Traditional Name: 2-(6-chloro-3-nitro-2-pyridyl)-2-(4-hexylphenyl)acetonitrile Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(C#N)C2=C(C=CC(=N2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(C#N)C2=C(C=CC(=N2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O2/c1-2-3-4-5-6-14-7-9-15(10-8-14)16(13-21)19-17(23(24)25)11-12-18(20)22-19/h7-12,16H,2-6H2,1H3