1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-5-(trifluoromethyl)indole-2-carboxylic acid

Systemtic Name: 1-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-5-(trifluoromethyl)indole-2-carboxylic acid Openeye Name: 1-(2-tert-butoxy-2-oxo-ethyl)-5-(trifluoromethyl)indole-2-carboxylic acid CAS Name: 1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-(trifluoromethyl)-2-indolecarboxylic acid IUPAC Name: 1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-5-(trifluoromethyl)indole-2-carboxylic acid Traditional Name: 1-(2-tert-butoxy-2-keto-ethyl)-5-(trifluoromethyl)indole-2-carboxylic acid Formula: C16H16F3NO4 MolecularWeight: 343.29775

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C2=C(C=C(C=C2)C(F)(F)F)C=C1C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)CN1C2=C(C=C(C=C2)C(F)(F)F)C=C1C(=O)O

InChI

InChI=1S/C16H16F3NO4/c1-15(2,3)24-13(21)8-20-11-5-4-10(16(17,18)19)6-9(11)7-12(20)14(22)23/h4-7H,8H2,1-3H3,(H,22,23)