ethyl (2S,3R)-2-(1,2-dimethylindol-3-yl)-5-oxidanylidene-4-propan-2-ylidene-2-(trifluoromethyl)oxolane-3-carboxylate

Systemtic Name: ethyl (2S,3R)-2-(1,2-dimethylindol-3-yl)-5-oxidanylidene-4-propan-2-ylidene-2-(trifluoromethyl)oxolane-3-carboxylate Openeye Name: ethyl (2S,3R)-2-(1,2-dimethylindol-3-yl)-4-isopropylidene-5-oxo-2-(trifluoromethyl)tetrahydrofuran-3-carboxylate CAS Name: (2S,3R)-2-(1,2-dimethyl-3-indolyl)-5-oxo-4-propan-2-ylidene-2-(trifluoromethyl)-3-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-(1,2-dimethylindol-3-yl)-5-oxo-4-propan-2-ylidene-2-(trifluoromethyl)oxolane-3-carboxylate Traditional Name: (2S,3R)-2-(1,2-dimethylindol-3-yl)-4-isopropylidene-5-keto-2-(trifluoromethyl)tetrahydrofuran-3-carboxylic acid ethyl ester Formula: C21H22F3NO4 MolecularWeight: 409.39889

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=C(C)C)C(=O)OC1(C2=C(N(C3=CC=CC=C32)C)C)C(F)(F)F

Isomeric SMILES

CCOC(=O)[C@@H]1C(=C(C)C)C(=O)O[C@@]1(C2=C(N(C3=CC=CC=C32)C)C)C(F)(F)F

InChI

InChI=1S/C21H22F3NO4/c1-6-28-19(27)17-15(11(2)3)18(26)29-20(17,21(22,23)24)16-12(4)25(5)14-10-8-7-9-13(14)16/h7-10,17H,6H2,1-5H3/t17-,20+/m0/s1