1-(4-tert-butylphenyl)-5-methoxy-3-[3-(trifluoromethyl)phenoxy]indole-2-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-5-methoxy-3-[3-(trifluoromethyl)phenoxy]indole-2-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-methoxy-3-[3-(trifluoromethyl)phenoxy]indole-2-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-5-methoxy-3-[3-(trifluoromethyl)phenoxy]-2-indolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-5-methoxy-3-[3-(trifluoromethyl)phenoxy]indole-2-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-methoxy-3-[3-(trifluoromethyl)phenoxy]indole-2-carboxylic acid Formula: C27H24F3NO4 MolecularWeight: 483.47897

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C3=C(C=C(C=C3)OC)C(=C2C(=O)O)OC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C3=C(C=C(C=C3)OC)C(=C2C(=O)O)OC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C27H24F3NO4/c1-26(2,3)16-8-10-18(11-9-16)31-22-13-12-19(34-4)15-21(22)24(23(31)25(32)33)35-20-7-5-6-17(14-20)27(28,29)30/h5-15H,1-4H3,(H,32,33)