2-[5-butan-2-yl-2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-butan-2-yl-2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-sec-butyl-2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid CAS Name: 2-[5-butan-2-yl-2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-butan-2-yl-2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-sec-butyl-2-[3-(trifluoromethyl)phenyl]-1H-indol-3-yl]acetic acid Formula: C21H20F3NO2 MolecularWeight: 375.38421

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H20F3NO2/c1-3-12(2)13-7-8-18-16(10-13)17(11-19(26)27)20(25-18)14-5-4-6-15(9-14)21(22,23)24/h4-10,12,25H,3,11H2,1-2H3,(H,26,27)