(4-decanoyloxy-3-fluoranyl-phenyl) 2-(4-octan-2-yloxyphenyl)benzoate

Systemtic Name: (4-decanoyloxy-3-fluoranyl-phenyl) 2-(4-octan-2-yloxyphenyl)benzoate Openeye Name: (4-decanoyloxy-3-fluoro-phenyl) 2-[4-(1-methylheptoxy)phenyl]benzoate CAS Name: 2-(4-octan-2-yloxyphenyl)benzoic acid [3-fluoro-4-(1-oxodecoxy)phenyl] ester IUPAC Name: (4-decanoyloxy-3-fluorophenyl) 2-(4-octan-2-yloxyphenyl)benzoate Traditional Name: 2-[4-(1-methylheptoxy)phenyl]benzoic acid (4-capryloxy-3-fluoro-phenyl) ester Formula: C37H47FO5 MolecularWeight: 590.764483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)OC(=O)C2=CC=CC=C2C3=CC=C(C=C3)OC(C)CCCCCC)F

Isomeric SMILES

CCCCCCCCCC(=O)OC1=C(C=C(C=C1)OC(=O)C2=CC=CC=C2C3=CC=C(C=C3)OC(C)CCCCCC)F

InChI

InChI=1S/C37H47FO5/c1-4-6-8-10-11-12-14-20-36(39)43-35-26-25-31(27-34(35)38)42-37(40)33-19-16-15-18-32(33)29-21-23-30(24-22-29)41-28(3)17-13-9-7-5-2/h15-16,18-19,21-28H,4-14,17,20H2,1-3H3