2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-[(4-nitrophenyl)methyl]propanedinitrile

Systemtic Name: 2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-[(4-nitrophenyl)methyl]propanedinitrile Openeye Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-[(4-nitrophenyl)methyl]propanedinitrile CAS Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-[(4-nitrophenyl)methyl]propanedinitrile IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-[(4-nitrophenyl)methyl]propanedinitrile Traditional Name: 2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-(4-nitrobenzyl)malononitrile Formula: C16H8ClF3N4O2 MolecularWeight: 380.70853

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C#N)(C#N)C2=C(C=C(C=N2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC(C#N)(C#N)C2=C(C=C(C=N2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H8ClF3N4O2/c17-13-5-11(16(18,19)20)7-23-14(13)15(8-21,9-22)6-10-1-3-12(4-2-10)24(25)26/h1-5,7H,6H2