[4-[(2S)-2-methylbutanoyl]oxyphenyl] 3-fluoranyl-4-tetradecoxy-benzoate

Systemtic Name: [4-[(2S)-2-methylbutanoyl]oxyphenyl] 3-fluoranyl-4-tetradecoxy-benzoate Openeye Name: [4-[(2S)-2-methylbutanoyl]oxyphenyl] 3-fluoro-4-tetradecoxy-benzoate CAS Name: 3-fluoro-4-tetradecoxybenzoic acid [4-[(2S)-2-methyl-1-oxobutoxy]phenyl] ester IUPAC Name: [4-[(2S)-2-methylbutanoyl]oxyphenyl] 3-fluoro-4-tetradecoxybenzoate Traditional Name: 3-fluoro-4-myristyloxy-benzoic acid [4-[(2S)-2-methylbutanoyl]oxyphenyl] ester Formula: C32H45FO5 MolecularWeight: 528.695103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C(C)CC)F

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)[C@@H](C)CC)F

InChI

InChI=1S/C32H45FO5/c1-4-6-7-8-9-10-11-12-13-14-15-16-23-36-30-22-17-26(24-29(30)33)32(35)38-28-20-18-27(19-21-28)37-31(34)25(3)5-2/h17-22,24-25H,4-16,23H2,1-3H3/t25-/m0/s1