4-[2-(2,6-dimethoxyphenyl)-5-(trifluoromethyloxy)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(2,6-dimethoxyphenyl)-5-(trifluoromethyloxy)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(2,6-dimethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(2,6-dimethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(2,6-dimethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(2,6-dimethoxyphenyl)-5-(trifluoromethoxy)-1H-indol-3-yl]butylamine Formula: C21H23F3N2O3 MolecularWeight: 408.41413

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23F3N2O3/c1-27-17-7-5-8-18(28-2)19(17)20-14(6-3-4-11-25)15-12-13(29-21(22,23)24)9-10-16(15)26-20/h5,7-10,12,26H,3-4,6,11,25H2,1-2H3