ethyl 2,5-bis(trifluoromethyl)-1H-indole-3-carboxylate

Systemtic Name: ethyl 2,5-bis(trifluoromethyl)-1H-indole-3-carboxylate Openeye Name: ethyl 2,5-bis(trifluoromethyl)-1H-indole-3-carboxylate CAS Name: 2,5-bis(trifluoromethyl)-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-bis(trifluoromethyl)-1H-indole-3-carboxylate Traditional Name: 2,5-bis(trifluoromethyl)-1H-indole-3-carboxylic acid ethyl ester Formula: C13H9F6NO2 MolecularWeight: 325.206479

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C1C=C(C=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(NC2=C1C=C(C=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H9F6NO2/c1-2-22-11(21)9-7-5-6(12(14,15)16)3-4-8(7)20-10(9)13(17,18)19/h3-5,20H,2H2,1H3