[4-(4-pentoxyphenyl)phenyl] 3-fluoranyl-4-nonyl-benzoate

Systemtic Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoranyl-4-nonyl-benzoate Openeye Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoro-4-nonyl-benzoate CAS Name: 3-fluoro-4-nonylbenzoic acid [4-(4-pentoxyphenyl)phenyl] ester IUPAC Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoro-4-nonylbenzoate Traditional Name: 3-fluoro-4-nonyl-benzoic acid [4-(4-amoxyphenyl)phenyl] ester Formula: C33H41FO3 MolecularWeight: 504.675243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCC)F

Isomeric SMILES

CCCCCCCCCC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCC)F

InChI

InChI=1S/C33H41FO3/c1-3-5-7-8-9-10-11-13-28-14-15-29(25-32(28)34)33(35)37-31-22-18-27(19-23-31)26-16-20-30(21-17-26)36-24-12-6-4-2/h14-23,25H,3-13,24H2,1-2H3