2-[2-(3-methoxy-4-phenylmethoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(3-methoxy-4-phenylmethoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-benzyloxy-3-methoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(3-methoxy-4-phenylmethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(3-methoxy-4-phenylmethoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-benzoxy-3-methoxy-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]acetic acid Formula: C25H20F3NO4 MolecularWeight: 455.42581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C3=C(N2)C(=CC=C3)C(F)(F)F)CC(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C3=C(N2)C(=CC=C3)C(F)(F)F)CC(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H20F3NO4/c1-32-21-12-16(10-11-20(21)33-14-15-6-3-2-4-7-15)23-18(13-22(30)31)17-8-5-9-19(24(17)29-23)25(26,27)28/h2-12,29H,13-14H2,1H3,(H,30,31)