2,2,2-tris(fluoranyl)ethyl 3,3-dimethyl-2-oxidanylidene-5-propanoyl-indole-1-carboxylate

Systemtic Name: 2,2,2-tris(fluoranyl)ethyl 3,3-dimethyl-2-oxidanylidene-5-propanoyl-indole-1-carboxylate Openeye Name: 2,2,2-trifluoroethyl 3,3-dimethyl-2-oxo-5-propanoyl-indoline-1-carboxylate CAS Name: 3,3-dimethyl-2-oxo-5-(1-oxopropyl)-1-indolecarboxylic acid 2,2,2-trifluoroethyl ester IUPAC Name: 2,2,2-trifluoroethyl 3,3-dimethyl-2-oxo-5-propanoylindole-1-carboxylate Traditional Name: 2-keto-3,3-dimethyl-5-propionyl-indoline-1-carboxylic acid 2,2,2-trifluoroethyl ester Formula: C16H16F3NO4 MolecularWeight: 343.29775

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)N(C(=O)C2(C)C)C(=O)OCC(F)(F)F

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)N(C(=O)C2(C)C)C(=O)OCC(F)(F)F

InChI

InChI=1S/C16H16F3NO4/c1-4-12(21)9-5-6-11-10(7-9)15(2,3)13(22)20(11)14(23)24-8-16(17,18)19/h5-7H,4,8H2,1-3H3