(1-ethoxy-1-oxidanylidene-propan-2-yl) 2,3-bis(fluoranyl)-4-(4-heptoxyphenyl)benzoate

Systemtic Name: (1-ethoxy-1-oxidanylidene-propan-2-yl) 2,3-bis(fluoranyl)-4-(4-heptoxyphenyl)benzoate Openeye Name: (2-ethoxy-1-methyl-2-oxo-ethyl) 2,3-difluoro-4-(4-heptoxyphenyl)benzoate CAS Name: 2,3-difluoro-4-(4-heptoxyphenyl)benzoic acid (1-ethoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-ethoxy-1-oxopropan-2-yl) 2,3-difluoro-4-(4-heptoxyphenyl)benzoate Traditional Name: 2,3-difluoro-4-(4-heptoxyphenyl)benzoic acid (2-ethoxy-2-keto-1-methyl-ethyl) ester Formula: C25H30F2O5 MolecularWeight: 448.499506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC(C)C(=O)OCC)F)F

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC(C)C(=O)OCC)F)F

InChI

InChI=1S/C25H30F2O5/c1-4-6-7-8-9-16-31-19-12-10-18(11-13-19)20-14-15-21(23(27)22(20)26)25(29)32-17(3)24(28)30-5-2/h10-15,17H,4-9,16H2,1-3H3