2-[2-(3,4-diethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3,4-diethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3,4-diethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3,4-diethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3,4-diethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3,4-diethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid Formula: C21H20F3NO4 MolecularWeight: 407.38301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20F3NO4/c1-3-28-16-9-8-12(10-17(16)29-4-2)19-14(11-18(26)27)13-6-5-7-15(20(13)25-19)21(22,23)24/h5-10,25H,3-4,11H2,1-2H3,(H,26,27)