[6-(trifluoromethyloxy)pyridin-3-yl] 4-heptoxybenzoate

Systemtic Name: [6-(trifluoromethyloxy)pyridin-3-yl] 4-heptoxybenzoate Openeye Name: [6-(trifluoromethoxy)-3-pyridyl] 4-heptoxybenzoate CAS Name: 4-heptoxybenzoic acid [6-(trifluoromethoxy)-3-pyridinyl] ester IUPAC Name: [6-(trifluoromethoxy)pyridin-3-yl] 4-heptoxybenzoate Traditional Name: 4-heptoxybenzoic acid [6-(trifluoromethoxy)-3-pyridyl] ester Formula: C20H22F3NO4 MolecularWeight: 397.38819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)OC(F)(F)F

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C20H22F3NO4/c1-2-3-4-5-6-13-26-16-9-7-15(8-10-16)19(25)27-17-11-12-18(24-14-17)28-20(21,22)23/h7-12,14H,2-6,13H2,1H3