1,3-benzoxazol-2-yl-butyl-[4-(trifluoromethyl)phenyl]azanium chloride

Systemtic Name: 1,3-benzoxazol-2-yl-butyl-[4-(trifluoromethyl)phenyl]azanium chloride Openeye Name: 1,3-benzoxazol-2-yl-butyl-[4-(trifluoromethyl)phenyl]ammonium chloride CAS Name: 1,3-benzoxazol-2-yl-butyl-[4-(trifluoromethyl)phenyl]ammonium chloride IUPAC Name: 1,3-benzoxazol-2-yl-butyl-[4-(trifluoromethyl)phenyl]azanium chloride Traditional Name: 1,3-benzoxazol-2-yl-butyl-[4-(trifluoromethyl)phenyl]ammonium chloride Formula: C18H18ClF3N2O MolecularWeight: 370.79653

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C1=CC=C(C=C1)C(F)(F)F)C2=NC3=CC=CC=C3O2.[Cl-]

Isomeric SMILES

CCCC[NH+](C1=CC=C(C=C1)C(F)(F)F)C2=NC3=CC=CC=C3O2.[Cl-]

InChI

InChI=1S/C18H17F3N2O.ClH/c1-2-3-12-23(14-10-8-13(9-11-14)18(19,20)21)17-22-15-6-4-5-7-16(15)24-17;/h4-11H,2-3,12H2,1H3;1H