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2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-4-nonyl-benzoic acid

2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-4-nonyl-benzoic acid

Systemtic Name:2-[2,3-bis(fluoranyl)-4-octoxy-phenyl]-4-nonyl-benzoic acid
Openeye Name:2-(2,3-difluoro-4-octoxy-phenyl)-4-nonyl-benzoic acid
CAS Name:2-(2,3-difluoro-4-octoxyphenyl)-4-nonylbenzoic acid
IUPAC Name:2-(2,3-difluoro-4-octoxyphenyl)-4-nonylbenzoic acid
Traditional Name:2-(2,3-difluoro-4-octoxy-phenyl)-4-nonyl-benzoic acid
Formula: C30H42F2O3
MolecularWeight: 488.649486
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=C(C=C1)C(=O)O)C2=C(C(=C(C=C2)OCCCCCCCC)F)F


Isomeric SMILES

CCCCCCCCCC1=CC(=C(C=C1)C(=O)O)C2=C(C(=C(C=C2)OCCCCCCCC)F)F


InChI

InChI=1S/C30H42F2O3/c1-3-5-7-9-11-12-14-16-23-17-18-25(30(33)34)26(22-23)24-19-20-27(29(32)28(24)31)35-21-15-13-10-8-6-4-2/h17-20,22H,3-16,21H2,1-2H3,(H,33,34)


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