4-[2-(2-chloranyl-4-fluoranyl-phenyl)-5-(trifluoromethyloxy)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(2-chloranyl-4-fluoranyl-phenyl)-5-(trifluoromethyloxy)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(2-chloro-4-fluoro-phenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(2-chloro-4-fluorophenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(2-chloro-4-fluorophenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(2-chloro-4-fluoro-phenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butylamine Formula: C19H17ClF4N2O MolecularWeight: 400.797693

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC(F)(F)F)C(=C(N2)C3=C(C=C(C=C3)F)Cl)CCCCN

Isomeric SMILES

C1=CC2=C(C=C1OC(F)(F)F)C(=C(N2)C3=C(C=C(C=C3)F)Cl)CCCCN

InChI

InChI=1S/C19H17ClF4N2O/c20-16-9-11(21)4-6-14(16)18-13(3-1-2-8-25)15-10-12(27-19(22,23)24)5-7-17(15)26-18/h4-7,9-10,26H,1-3,8,25H2