[4-(4-nonylphenyl)phenyl] 3,3,3-tris(fluoranyl)-2-heptoxy-propanoate

Systemtic Name: [4-(4-nonylphenyl)phenyl] 3,3,3-tris(fluoranyl)-2-heptoxy-propanoate Openeye Name: [4-(4-nonylphenyl)phenyl] 3,3,3-trifluoro-2-heptoxy-propanoate CAS Name: 3,3,3-trifluoro-2-heptoxypropanoic acid [4-(4-nonylphenyl)phenyl] ester IUPAC Name: [4-(4-nonylphenyl)phenyl] 3,3,3-trifluoro-2-heptoxypropanoate Traditional Name: 3,3,3-trifluoro-2-heptoxy-propionic acid [4-(4-nonylphenyl)phenyl] ester Formula: C31H43F3O3 MolecularWeight: 520.66653

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C(F)(F)F)OCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C(F)(F)F)OCCCCCCC

InChI

InChI=1S/C31H43F3O3/c1-3-5-7-9-10-11-13-15-25-16-18-26(19-17-25)27-20-22-28(23-21-27)37-30(35)29(31(32,33)34)36-24-14-12-8-6-4-2/h16-23,29H,3-15,24H2,1-2H3