phenyl 4-(2-fluoranylhexadecoxy)-2-hexoxy-benzoate

Systemtic Name: phenyl 4-(2-fluoranylhexadecoxy)-2-hexoxy-benzoate Openeye Name: phenyl 4-(2-fluorohexadecoxy)-2-hexoxy-benzoate CAS Name: 4-(2-fluorohexadecoxy)-2-hexoxybenzoic acid phenyl ester IUPAC Name: phenyl 4-(2-fluorohexadecoxy)-2-hexoxybenzoate Traditional Name: 4-(2-fluorohexadecoxy)-2-hexoxy-benzoic acid phenyl ester Formula: C35H53FO4 MolecularWeight: 556.791323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(COC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)OCCCCCC)F

Isomeric SMILES

CCCCCCCCCCCCCCC(COC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)OCCCCCC)F

InChI

InChI=1S/C35H53FO4/c1-3-5-7-9-10-11-12-13-14-15-16-18-22-30(36)29-39-32-25-26-33(34(28-32)38-27-21-8-6-4-2)35(37)40-31-23-19-17-20-24-31/h17,19-20,23-26,28,30H,3-16,18,21-22,27,29H2,1-2H3