dimethyl 5-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxylate CAS Name: 5-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H13F3O4 MolecularWeight: 338.27793

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C2=CC(=CC=C2)C(F)(F)F)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C2=CC(=CC=C2)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C17H13F3O4/c1-23-15(21)12-6-11(7-13(8-12)16(22)24-2)10-4-3-5-14(9-10)17(18,19)20/h3-9H,1-2H3