(4-decoxyphenyl) 4-(3-fluoranyl-5-methyl-hexan-2-yl)oxybenzoate

Systemtic Name: (4-decoxyphenyl) 4-(3-fluoranyl-5-methyl-hexan-2-yl)oxybenzoate Openeye Name: (4-decoxyphenyl) 4-(2-fluoro-1,4-dimethyl-pentoxy)benzoate CAS Name: 4-(3-fluoro-5-methylhexan-2-yl)oxybenzoic acid (4-decoxyphenyl) ester IUPAC Name: (4-decoxyphenyl) 4-(3-fluoro-5-methylhexan-2-yl)oxybenzoate Traditional Name: 4-(2-fluoro-1,4-dimethyl-pentoxy)benzoic acid (4-decoxyphenyl) ester Formula: C30H43FO4 MolecularWeight: 486.658423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC(C)C(CC(C)C)F

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC(C)C(CC(C)C)F

InChI

InChI=1S/C30H43FO4/c1-5-6-7-8-9-10-11-12-21-33-26-17-19-28(20-18-26)35-30(32)25-13-15-27(16-14-25)34-24(4)29(31)22-23(2)3/h13-20,23-24,29H,5-12,21-22H2,1-4H3