5-methyl-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-6-(trifluoromethyl)indole-2-carboxylic acid

Systemtic Name: 5-methyl-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-6-(trifluoromethyl)indole-2-carboxylic acid Openeye Name: 1-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]-5-methyl-6-(trifluoromethyl)indole-2-carboxylic acid CAS Name: 5-methyl-1-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl]-6-(trifluoromethyl)-2-indolecarboxylic acid IUPAC Name: 5-methyl-1-[1-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-6-(trifluoromethyl)indole-2-carboxylic acid Traditional Name: 1-[2-(tert-butoxycarbonylamino)-1-methyl-ethyl]-5-methyl-6-(trifluoromethyl)indole-2-carboxylic acid Formula: C19H23F3N2O4 MolecularWeight: 400.39213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(N2C(C)CNC(=O)OC(C)(C)C)C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(N2C(C)CNC(=O)OC(C)(C)C)C(=O)O)C(F)(F)F

InChI

InChI=1S/C19H23F3N2O4/c1-10-6-12-7-15(16(25)26)24(14(12)8-13(10)19(20,21)22)11(2)9-23-17(27)28-18(3,4)5/h6-8,11H,9H2,1-5H3,(H,23,27)(H,25,26)