[4-(2-fluoranylnonoxycarbonyl)phenyl] 4-(12-bromanyldodecoxy)benzoate

Systemtic Name: [4-(2-fluoranylnonoxycarbonyl)phenyl] 4-(12-bromanyldodecoxy)benzoate Openeye Name: [4-(2-fluorononoxycarbonyl)phenyl] 4-(12-bromododecoxy)benzoate CAS Name: 4-(12-bromododecoxy)benzoic acid [4-[2-fluorononoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-fluorononoxycarbonyl)phenyl] 4-(12-bromododecoxy)benzoate Traditional Name: 4-(12-bromododecoxy)benzoic acid [4-(2-fluorononoxycarbonyl)phenyl] ester Formula: C35H50BrFO5 MolecularWeight: 649.670903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(COC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCCCCCCBr)F

Isomeric SMILES

CCCCCCCC(COC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCCCCCCBr)F

InChI

InChI=1S/C35H50BrFO5/c1-2-3-4-11-14-17-31(37)28-41-34(38)29-20-24-33(25-21-29)42-35(39)30-18-22-32(23-19-30)40-27-16-13-10-8-6-5-7-9-12-15-26-36/h18-25,31H,2-17,26-28H2,1H3