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

Systemtic Name: [4-(4-heptylphenyl)phenyl] 3-fluoranyl-4-octan-2-yloxy-benzoate Openeye Name: [4-(4-heptylphenyl)phenyl] 3-fluoro-4-(1-methylheptoxy)benzoate CAS Name: 3-fluoro-4-octan-2-yloxybenzoic acid [4-(4-heptylphenyl)phenyl] ester IUPAC Name: [4-(4-heptylphenyl)phenyl] 3-fluoro-4-octan-2-yloxybenzoate Traditional Name: 3-fluoro-4-(1-methylheptoxy)benzoic acid [4-(4-heptylphenyl)phenyl] ester Formula: C34H43FO3 MolecularWeight: 518.701823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OC(C)CCCCCC)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OC(C)CCCCCC)F

InChI

InChI=1S/C34H43FO3/c1-4-6-8-10-12-14-27-15-17-28(18-16-27)29-19-22-31(23-20-29)38-34(36)30-21-24-33(32(35)25-30)37-26(3)13-11-9-7-5-2/h15-26H,4-14H2,1-3H3