(4-nonan-2-yloxyphenyl) 2-(4-decanoyloxy-2-fluoranyl-phenyl)benzoate

Systemtic Name: (4-nonan-2-yloxyphenyl) 2-(4-decanoyloxy-2-fluoranyl-phenyl)benzoate Openeye Name: [4-(1-methyloctoxy)phenyl] 2-(4-decanoyloxy-2-fluoro-phenyl)benzoate CAS Name: 2-[2-fluoro-4-(1-oxodecoxy)phenyl]benzoic acid (4-nonan-2-yloxyphenyl) ester IUPAC Name: (4-nonan-2-yloxyphenyl) 2-(4-decanoyloxy-2-fluorophenyl)benzoate Traditional Name: 2-(4-capryloxy-2-fluoro-phenyl)benzoic acid [4-(1-methyloctoxy)phenyl] ester Formula: C38H49FO5 MolecularWeight: 604.791063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)OC(C)CCCCCCC)F

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)OC(C)CCCCCCC)F

InChI

InChI=1S/C38H49FO5/c1-4-6-8-10-11-13-15-21-37(40)43-32-26-27-34(36(39)28-32)33-19-16-17-20-35(33)38(41)44-31-24-22-30(23-25-31)42-29(3)18-14-12-9-7-5-2/h16-17,19-20,22-29H,4-15,18,21H2,1-3H3