(4-pentan-3-yloxycarbonylphenyl) 4-(4-decoxyphenyl)-2-fluoranyl-benzoate

Systemtic Name: (4-pentan-3-yloxycarbonylphenyl) 4-(4-decoxyphenyl)-2-fluoranyl-benzoate Openeye Name: [4-(1-ethylpropoxycarbonyl)phenyl] 4-(4-decoxyphenyl)-2-fluoro-benzoate CAS Name: 4-(4-decoxyphenyl)-2-fluorobenzoic acid [4-[oxo(pentan-3-yloxy)methyl]phenyl] ester IUPAC Name: (4-pentan-3-yloxycarbonylphenyl) 4-(4-decoxyphenyl)-2-fluorobenzoate Traditional Name: 4-(4-decoxyphenyl)-2-fluoro-benzoic acid [4-(1-ethylpropoxycarbonyl)phenyl] ester Formula: C35H43FO5 MolecularWeight: 562.711323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(CC)CC)F

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(CC)CC)F

InChI

InChI=1S/C35H43FO5/c1-4-7-8-9-10-11-12-13-24-39-30-19-14-26(15-20-30)28-18-23-32(33(36)25-28)35(38)41-31-21-16-27(17-22-31)34(37)40-29(5-2)6-3/h14-23,25,29H,4-13,24H2,1-3H3