ethyl 2-[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]phenyl]benzoate

Systemtic Name: ethyl 2-[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]phenyl]benzoate Openeye Name: ethyl 2-[3-[(4-acetyl-3-hydroxy-2-propyl-phenyl)methoxy]phenyl]benzoate CAS Name: 2-[3-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]phenyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]phenyl]benzoate Traditional Name: 2-[3-(4-acetyl-3-hydroxy-2-propyl-benzyl)oxyphenyl]benzoic acid ethyl ester Formula: C27H28O5 MolecularWeight: 432.50822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)COC2=CC=CC(=C2)C3=CC=CC=C3C(=O)OCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)COC2=CC=CC(=C2)C3=CC=CC=C3C(=O)OCC

InChI

InChI=1S/C27H28O5/c1-4-9-24-20(14-15-22(18(3)28)26(24)29)17-32-21-11-8-10-19(16-21)23-12-6-7-13-25(23)27(30)31-5-2/h6-8,10-16,29H,4-5,9,17H2,1-3H3