4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline

Systemtic Name: 4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline Openeye Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]-2-(trifluoromethyl)quinoline CAS Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-(trifluoromethyl)quinoline IUPAC Name: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-(trifluoromethyl)quinoline Traditional Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazino]-2-(trifluoromethyl)quinoline Formula: C20H15ClF6N4 MolecularWeight: 460.803319

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C4=C(C=C(C=N4)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C4=C(C=C(C=N4)C(F)(F)F)Cl

InChI

InChI=1S/C20H15ClF6N4/c21-14-9-12(19(22,23)24)11-28-18(14)31-7-5-30(6-8-31)16-10-17(20(25,26)27)29-15-4-2-1-3-13(15)16/h1-4,9-11H,5-8H2