octan-2-yl 4-[4-(4-decoxyphenyl)phenyl]carbonyloxy-3-fluoranyl-benzoate

Systemtic Name: octan-2-yl 4-[4-(4-decoxyphenyl)phenyl]carbonyloxy-3-fluoranyl-benzoate Openeye Name: 1-methylheptyl 4-[4-(4-decoxyphenyl)benzoyl]oxy-3-fluoro-benzoate CAS Name: 4-[[4-(4-decoxyphenyl)phenyl]-oxomethoxy]-3-fluorobenzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-[4-(4-decoxyphenyl)benzoyl]oxy-3-fluorobenzoate Traditional Name: 4-[4-(4-decoxyphenyl)benzoyl]oxy-3-fluoro-benzoic acid 1-methylheptyl ester Formula: C38H49FO5 MolecularWeight: 604.791063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C(=O)OC(C)CCCCCC)F

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C(=O)OC(C)CCCCCC)F

InChI

InChI=1S/C38H49FO5/c1-4-6-8-10-11-12-13-15-27-42-34-24-21-31(22-25-34)30-17-19-32(20-18-30)37(40)44-36-26-23-33(28-35(36)39)38(41)43-29(3)16-14-9-7-5-2/h17-26,28-29H,4-16,27H2,1-3H3