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

Systemtic Name: (phenylmethyl) 3-oxidanylidene-2-(trifluoromethyl)-1H-indene-2-carboxylate Openeye Name: benzyl 1-oxo-2-(trifluoromethyl)indane-2-carboxylate CAS Name: 3-oxo-2-(trifluoromethyl)-1H-indene-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxo-2-(trifluoromethyl)-1H-indene-2-carboxylate Traditional Name: 1-keto-2-(trifluoromethyl)indane-2-carboxylic acid benzyl ester Formula: C18H13F3O3 MolecularWeight: 334.28923

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)C1(C(=O)OCC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

C1C2=CC=CC=C2C(=O)C1(C(=O)OCC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H13F3O3/c19-18(20,21)17(10-13-8-4-5-9-14(13)15(17)22)16(23)24-11-12-6-2-1-3-7-12/h1-9H,10-11H2