4-[2-(5-bromanyl-2-methoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanyl-2-methoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-2-methoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-2-methoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromo-2-methoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-2-methoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C20H20BrF3N2O MolecularWeight: 441.28481

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=C(C3=C(N2)C(=CC=C3)C(F)(F)F)CCCCN

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=C(C3=C(N2)C(=CC=C3)C(F)(F)F)CCCCN

InChI

InChI=1S/C20H20BrF3N2O/c1-27-17-9-8-12(21)11-15(17)18-13(5-2-3-10-25)14-6-4-7-16(19(14)26-18)20(22,23)24/h4,6-9,11,26H,2-3,5,10,25H2,1H3