[4-(4-nonylphenyl)phenyl] 3-fluoranyl-4-nonoxy-benzoate

Systemtic Name: [4-(4-nonylphenyl)phenyl] 3-fluoranyl-4-nonoxy-benzoate Openeye Name: [4-(4-nonylphenyl)phenyl] 3-fluoro-4-nonoxy-benzoate CAS Name: 3-fluoro-4-nonoxybenzoic acid [4-(4-nonylphenyl)phenyl] ester IUPAC Name: [4-(4-nonylphenyl)phenyl] 3-fluoro-4-nonoxybenzoate Traditional Name: 3-fluoro-4-nonoxy-benzoic acid [4-(4-nonylphenyl)phenyl] ester Formula: C37H49FO3 MolecularWeight: 560.781563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OCCCCCCCCC)F

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OCCCCCCCCC)F

InChI

InChI=1S/C37H49FO3/c1-3-5-7-9-11-13-15-17-30-18-20-31(21-19-30)32-22-25-34(26-23-32)41-37(39)33-24-27-36(35(38)29-33)40-28-16-14-12-10-8-6-4-2/h18-27,29H,3-17,28H2,1-2H3