(2R)-2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-morpholin-4-ium-4-yl-2-pyridin-2-yl-ethanenitrile

Systemtic Name: (2R)-2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-morpholin-4-ium-4-yl-2-pyridin-2-yl-ethanenitrile Openeye Name: (2R)-2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-morpholin-4-ium-4-yl-2-(2-pyridyl)acetonitrile CAS Name: (2R)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-(4-morpholin-4-iumyl)-2-(2-pyridinyl)acetonitrile IUPAC Name: (2R)-2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-morpholin-4-ium-4-yl-2-pyridin-2-ylacetonitrile Traditional Name: (2R)-2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-morpholin-4-ium-4-yl-2-(2-pyridyl)acetonitrile Formula: C17H15ClF3N4O+ MolecularWeight: 383.77541

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(C#N)(C2=CC=CC=N2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1COCC[NH+]1[C@](C#N)(C2=CC=CC=N2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C17H14ClF3N4O/c18-13-9-12(17(19,20)21)10-24-15(13)16(11-22,14-3-1-2-4-23-14)25-5-7-26-8-6-25/h1-4,9-10H,5-8H2/p+1/t16-/m1/s1