2-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethylamino]-5-nitro-pyridine-3-carbonitrile

Systemtic Name: 2-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethylamino]-5-nitro-pyridine-3-carbonitrile Openeye Name: 2-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethylamino]-5-nitro-pyridine-3-carbonitrile CAS Name: 2-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethylamino]-5-nitro-3-pyridinecarbonitrile IUPAC Name: 2-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethylamino]-5-nitropyridine-3-carbonitrile Traditional Name: 2-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethylamino]-5-nitro-nicotinonitrile Formula: C14H10ClF3N6O2 MolecularWeight: 386.71641

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1Cl)NCCNC2=NC=C(C=C2C#N)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=C(C=NC(=C1Cl)NCCNC2=NC=C(C=C2C#N)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H10ClF3N6O2/c15-11-4-9(14(16,17)18)6-22-13(11)21-2-1-20-12-8(5-19)3-10(7-23-12)24(25)26/h3-4,6-7H,1-2H2,(H,20,23)(H,21,22)