(2-decoxyphenyl) 3-fluoranyl-4-(2-fluoranyl-4-methyl-pentoxy)benzoate

Systemtic Name: (2-decoxyphenyl) 3-fluoranyl-4-(2-fluoranyl-4-methyl-pentoxy)benzoate Openeye Name: (2-decoxyphenyl) 3-fluoro-4-(2-fluoro-4-methyl-pentoxy)benzoate CAS Name: 3-fluoro-4-(2-fluoro-4-methylpentoxy)benzoic acid (2-decoxyphenyl) ester IUPAC Name: (2-decoxyphenyl) 3-fluoro-4-(2-fluoro-4-methylpentoxy)benzoate Traditional Name: 3-fluoro-4-(2-fluoro-4-methyl-pentoxy)benzoic acid (2-decoxyphenyl) ester Formula: C29H40F2O4 MolecularWeight: 490.622306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)OCC(CC(C)C)F)F

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)OCC(CC(C)C)F)F

InChI

InChI=1S/C29H40F2O4/c1-4-5-6-7-8-9-10-13-18-33-27-14-11-12-15-28(27)35-29(32)23-16-17-26(25(31)20-23)34-21-24(30)19-22(2)3/h11-12,14-17,20,22,24H,4-10,13,18-19,21H2,1-3H3