[4-(trifluoromethyl)phenyl]methyl 5-(4-octoxyphenyl)carbonyloxy-2-oxidanyl-benzoate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl 5-(4-octoxyphenyl)carbonyloxy-2-oxidanyl-benzoate Openeye Name: [4-(trifluoromethyl)phenyl]methyl 2-hydroxy-5-(4-octoxybenzoyl)oxy-benzoate CAS Name: 2-hydroxy-5-[(4-octoxyphenyl)-oxomethoxy]benzoic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl 2-hydroxy-5-(4-octoxybenzoyl)oxybenzoate Traditional Name: 2-hydroxy-5-(4-octoxybenzoyl)oxy-benzoic acid [4-(trifluoromethyl)benzyl] ester Formula: C30H31F3O6 MolecularWeight: 544.55875

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)O)C(=O)OCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)O)C(=O)OCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C30H31F3O6/c1-2-3-4-5-6-7-18-37-24-14-10-22(11-15-24)28(35)39-25-16-17-27(34)26(19-25)29(36)38-20-21-8-12-23(13-9-21)30(31,32)33/h8-17,19,34H,2-7,18,20H2,1H3