2-(4-chloranyl-2-methyl-5-propan-2-yl-phenoxy)-3,3,3-tris(fluoranyl)propan-1-amine

Systemtic Name: 2-(4-chloranyl-2-methyl-5-propan-2-yl-phenoxy)-3,3,3-tris(fluoranyl)propan-1-amine Openeye Name: 2-(4-chloro-5-isopropyl-2-methyl-phenoxy)-3,3,3-trifluoro-propan-1-amine CAS Name: 2-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-3,3,3-trifluoro-1-propanamine IUPAC Name: 2-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-3,3,3-trifluoropropan-1-amine Traditional Name: [2-(4-chloro-5-isopropyl-2-methyl-phenoxy)-3,3,3-trifluoro-propyl]amine Formula: C13H17ClF3NO MolecularWeight: 295.72839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)Cl)C(C)C)OC(CN)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C(=C1)Cl)C(C)C)OC(CN)C(F)(F)F

InChI

InChI=1S/C13H17ClF3NO/c1-7(2)9-5-11(8(3)4-10(9)14)19-12(6-18)13(15,16)17/h4-5,7,12H,6,18H2,1-3H3