4-[2-(3,4-diethoxyphenyl)-5-(trifluoromethyloxy)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(3,4-diethoxyphenyl)-5-(trifluoromethyloxy)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(3,4-diethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(3,4-diethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(3,4-diethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(3,4-diethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butylamine Formula: C23H27F3N2O3 MolecularWeight: 436.46729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC(F)(F)F)CCCCN)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=C(C3=C(N2)C=CC(=C3)OC(F)(F)F)CCCCN)OCC

InChI

InChI=1S/C23H27F3N2O3/c1-3-29-20-11-8-15(13-21(20)30-4-2)22-17(7-5-6-12-27)18-14-16(31-23(24,25)26)9-10-19(18)28-22/h8-11,13-14,28H,3-7,12,27H2,1-2H3