methyl 3-oxidanylidene-2-(trifluoromethyl)-1H-indene-2-carboxylate

Systemtic Name: methyl 3-oxidanylidene-2-(trifluoromethyl)-1H-indene-2-carboxylate Openeye Name: methyl 1-oxo-2-(trifluoromethyl)indane-2-carboxylate CAS Name: 3-oxo-2-(trifluoromethyl)-1H-indene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-oxo-2-(trifluoromethyl)-1H-indene-2-carboxylate Traditional Name: 1-keto-2-(trifluoromethyl)indane-2-carboxylic acid methyl ester Formula: C12H9F3O3 MolecularWeight: 258.19327

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC2=CC=CC=C2C1=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1(CC2=CC=CC=C2C1=O)C(F)(F)F

InChI

InChI=1S/C12H9F3O3/c1-18-10(17)11(12(13,14)15)6-7-4-2-3-5-8(7)9(11)16/h2-5H,6H2,1H3