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

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

Systemtic Name: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]-6-(trifluoromethyl)indole-2-carboxylic acid
CAS Name:1-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl]-6-(trifluoromethyl)-2-indolecarboxylic acid
IUPAC Name: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]-6-(trifluoromethyl)indole-2-carboxylic acid
Formula: C18H21F3N2O4
MolecularWeight: 386.36555
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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)OC(C)(C)C)N1C(=CC2=C1C=C(C=C2)C(F)(F)F)C(=O)O


Isomeric SMILES

CC(CNC(=O)OC(C)(C)C)N1C(=CC2=C1C=C(C=C2)C(F)(F)F)C(=O)O


InChI

InChI=1S/C18H21F3N2O4/c1-10(9-22-16(26)27-17(2,3)4)23-13-8-12(18(19,20)21)6-5-11(13)7-14(23)15(24)25/h5-8,10H,9H2,1-4H3,(H,22,26)(H,24,25)


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