3-methoxy-4-propoxy-5-[3-(trifluoromethyl)phenyl]benzoate

Systemtic Name: 3-methoxy-4-propoxy-5-[3-(trifluoromethyl)phenyl]benzoate Openeye Name: 3-methoxy-4-propoxy-5-[3-(trifluoromethyl)phenyl]benzoate CAS Name: 3-methoxy-4-propoxy-5-[3-(trifluoromethyl)phenyl]benzoate IUPAC Name: 3-methoxy-4-propoxy-5-[3-(trifluoromethyl)phenyl]benzoate Traditional Name: 3-methoxy-4-propoxy-5-[3-(trifluoromethyl)phenyl]benzoate Formula: C18H16F3O4- MolecularWeight: 353.31245

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C2=CC(=CC=C2)C(F)(F)F)C(=O)[O-])OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1C2=CC(=CC=C2)C(F)(F)F)C(=O)[O-])OC

InChI

InChI=1S/C18H17F3O4/c1-3-7-25-16-14(9-12(17(22)23)10-15(16)24-2)11-5-4-6-13(8-11)18(19,20)21/h4-6,8-10H,3,7H2,1-2H3,(H,22,23)/p-1