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(4-hexoxyphenyl) 4-(3-fluoranyl-4-hexyl-phenyl)benzoate

Systemtic Name:	(4-hexoxyphenyl) 4-(3-fluoranyl-4-hexyl-phenyl)benzoate
Openeye Name:	(4-hexoxyphenyl) 4-(3-fluoro-4-hexyl-phenyl)benzoate
CAS Name:	4-(3-fluoro-4-hexylphenyl)benzoic acid (4-hexoxyphenyl) ester
IUPAC Name:	(4-hexoxyphenyl) 4-(3-fluoro-4-hexylphenyl)benzoate
Traditional Name:	4-(3-fluoro-4-hexyl-phenyl)benzoic acid (4-hexoxyphenyl) ester
Formula:	C₃₁H₃₇FO₃
MolecularWeight:	476.622083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCC)F

Isomeric SMILES

CCCCCCC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCC)F

InChI

InChI=1S/C31H37FO3/c1-3-5-7-9-11-25-14-17-27(23-30(25)32)24-12-15-26(16-13-24)31(33)35-29-20-18-28(19-21-29)34-22-10-8-6-4-2/h12-21,23H,3-11,22H2,1-2H3

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