[4-(4-nonylphenyl)phenyl] 3-fluoranyl-4-octan-2-yloxy-benzoate

Systemtic Name: [4-(4-nonylphenyl)phenyl] 3-fluoranyl-4-octan-2-yloxy-benzoate Openeye Name: [4-(4-nonylphenyl)phenyl] 3-fluoro-4-(1-methylheptoxy)benzoate CAS Name: 3-fluoro-4-octan-2-yloxybenzoic acid [4-(4-nonylphenyl)phenyl] ester IUPAC Name: [4-(4-nonylphenyl)phenyl] 3-fluoro-4-octan-2-yloxybenzoate Traditional Name: 3-fluoro-4-(1-methylheptoxy)benzoic acid [4-(4-nonylphenyl)phenyl] ester Formula: C36H47FO3 MolecularWeight: 546.754983

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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)OC(C)CCCCCC)F

Isomeric SMILES

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

InChI

InChI=1S/C36H47FO3/c1-4-6-8-10-11-12-14-16-29-17-19-30(20-18-29)31-21-24-33(25-22-31)40-36(38)32-23-26-35(34(37)27-32)39-28(3)15-13-9-7-5-2/h17-28H,4-16H2,1-3H3