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(4-nonoxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate

(4-nonoxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate

Systemtic Name:(4-nonoxycarbonylphenyl) 4-decanoyloxy-3-fluoranyl-benzoate
Openeye Name:(4-nonoxycarbonylphenyl) 4-decanoyloxy-3-fluoro-benzoate
CAS Name:3-fluoro-4-(1-oxodecoxy)benzoic acid [4-[nonoxy(oxo)methyl]phenyl] ester
IUPAC Name:(4-nonoxycarbonylphenyl) 4-decanoyloxy-3-fluorobenzoate
Traditional Name:4-capryloxy-3-fluoro-benzoic acid (4-nonoxycarbonylphenyl) ester
Formula: C33H45FO6
MolecularWeight: 556.705203
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCCCCCCCC)F


Isomeric SMILES

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OCCCCCCCCC)F


InChI

InChI=1S/C33H45FO6/c1-3-5-7-9-11-13-15-17-31(35)40-30-23-20-27(25-29(30)34)33(37)39-28-21-18-26(19-22-28)32(36)38-24-16-14-12-10-8-6-4-2/h18-23,25H,3-17,24H2,1-2H3


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