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2-[4-decyl-2,3-bis(fluoranyl)phenyl]-4-octoxy-benzoate

2-[4-decyl-2,3-bis(fluoranyl)phenyl]-4-octoxy-benzoate

Systemtic Name:2-[4-decyl-2,3-bis(fluoranyl)phenyl]-4-octoxy-benzoate
Openeye Name:2-(4-decyl-2,3-difluoro-phenyl)-4-octoxy-benzoate
CAS Name:2-(4-decyl-2,3-difluorophenyl)-4-octoxybenzoate
IUPAC Name:2-(4-decyl-2,3-difluorophenyl)-4-octoxybenzoate
Traditional Name:2-(4-decyl-2,3-difluoro-phenyl)-4-octoxy-benzoate
Formula: C31H43F2O3-
MolecularWeight: 501.668126
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C(=C(C=C1)C2=C(C=CC(=C2)OCCCCCCCC)C(=O)[O-])F)F


Isomeric SMILES

CCCCCCCCCCC1=C(C(=C(C=C1)C2=C(C=CC(=C2)OCCCCCCCC)C(=O)[O-])F)F


InChI

InChI=1S/C31H44F2O3/c1-3-5-7-9-11-12-13-15-17-24-18-20-26(30(33)29(24)32)28-23-25(19-21-27(28)31(34)35)36-22-16-14-10-8-6-4-2/h18-21,23H,3-17,22H2,1-2H3,(H,34,35)/p-1


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