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

Systemtic Name: (2R)-2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-morpholin-4-ium-4-yl-2-phenyl-ethanenitrile Openeye Name: (2R)-2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-morpholin-4-ium-4-yl-2-phenyl-acetonitrile CAS Name: (2R)-2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-(4-morpholin-4-iumyl)-2-phenylacetonitrile IUPAC Name: (2R)-2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-morpholin-4-ium-4-yl-2-phenylacetonitrile Traditional Name: (2R)-2-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-morpholin-4-ium-4-yl-2-phenyl-acetonitrile Formula: C18H16ClF3N3O+ MolecularWeight: 382.78735

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClF3N3O/c19-15-10-14(18(20,21)22)11-24-16(15)17(12-23,13-4-2-1-3-5-13)25-6-8-26-9-7-25/h1-5,10-11H,6-9H2/p+1/t17-/m1/s1