1-(4-tert-butylphenyl)-3-[4-(trifluoromethyloxy)phenoxy]indole-2-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-3-[4-(trifluoromethyloxy)phenoxy]indole-2-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-3-[4-(trifluoromethoxy)phenoxy]indole-2-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-3-[4-(trifluoromethoxy)phenoxy]-2-indolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-3-[4-(trifluoromethoxy)phenoxy]indole-2-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-3-[4-(trifluoromethoxy)phenoxy]indole-2-carboxylic acid Formula: C26H22F3NO4 MolecularWeight: 469.45239

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C3=CC=CC=C3C(=C2C(=O)O)OC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C3=CC=CC=C3C(=C2C(=O)O)OC4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C26H22F3NO4/c1-25(2,3)16-8-10-17(11-9-16)30-21-7-5-4-6-20(21)23(22(30)24(31)32)33-18-12-14-19(15-13-18)34-26(27,28)29/h4-15H,1-3H3,(H,31,32)