pentan-2-yl 2-[4-(4-tetradecoxyphenyl)phenyl]carbonyloxybenzoate

Systemtic Name: pentan-2-yl 2-[4-(4-tetradecoxyphenyl)phenyl]carbonyloxybenzoate Openeye Name: 1-methylbutyl 2-[4-(4-tetradecoxyphenyl)benzoyl]oxybenzoate CAS Name: 2-[oxo-[4-(4-tetradecoxyphenyl)phenyl]methoxy]benzoic acid pentan-2-yl ester IUPAC Name: pentan-2-yl 2-[4-(4-tetradecoxyphenyl)benzoyl]oxybenzoate Traditional Name: 2-[4-(4-myristyloxyphenyl)benzoyl]oxybenzoic acid 1-methylbutyl ester Formula: C39H52O5 MolecularWeight: 600.82718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OC(C)CCC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OC(C)CCC

InChI

InChI=1S/C39H52O5/c1-4-6-7-8-9-10-11-12-13-14-15-18-30-42-35-28-26-33(27-29-35)32-22-24-34(25-23-32)38(40)44-37-21-17-16-20-36(37)39(41)43-31(3)19-5-2/h16-17,20-29,31H,4-15,18-19,30H2,1-3H3