O1-(3-fluorophenyl) O2-octan-2-yl 4-octoxybenzene-1,2-dicarboxylate

Systemtic Name: O1-(3-fluorophenyl) O2-octan-2-yl 4-octoxybenzene-1,2-dicarboxylate Openeye Name: O1-(3-fluorophenyl) O2-(1-methylheptyl) 4-octoxybenzene-1,2-dicarboxylate CAS Name: 4-octoxybenzene-1,2-dicarboxylic acid O1-(3-fluorophenyl) ester O2-octan-2-yl ester IUPAC Name: 1-O-(3-fluorophenyl) 2-O-octan-2-yl 4-octoxybenzene-1,2-dicarboxylate Traditional Name: 4-octoxybenzene-1,2-dicarboxylic acid O1-(3-fluorophenyl) ester O2-(1-methylheptyl) ester Formula: C30H41FO5 MolecularWeight: 500.641943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC(=CC=C2)F)C(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC(=CC=C2)F)C(=O)OC(C)CCCCCC

InChI

InChI=1S/C30H41FO5/c1-4-6-8-10-11-13-20-34-25-18-19-27(29(32)36-26-17-14-16-24(31)21-26)28(22-25)30(33)35-23(3)15-12-9-7-5-2/h14,16-19,21-23H,4-13,15,20H2,1-3H3