ethyl 3-[2-(3-methylbutoxy)-5-[4-(2-methylpropoxy)-2-oxidanyl-phenyl]carbonyl-phenyl]propanoate

Systemtic Name: ethyl 3-[2-(3-methylbutoxy)-5-[4-(2-methylpropoxy)-2-oxidanyl-phenyl]carbonyl-phenyl]propanoate Openeye Name: ethyl 3-[5-(2-hydroxy-4-isobutoxy-benzoyl)-2-isopentyloxy-phenyl]propanoate CAS Name: 3-[5-[[2-hydroxy-4-(2-methylpropoxy)phenyl]-oxomethyl]-2-(3-methylbutoxy)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-[2-hydroxy-4-(2-methylpropoxy)benzoyl]-2-(3-methylbutoxy)phenyl]propanoate Traditional Name: 3-[5-(2-hydroxy-4-isobutoxy-benzoyl)-2-isoamoxy-phenyl]propionic acid ethyl ester Formula: C27H36O6 MolecularWeight: 456.57114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(C=CC(=C1)C(=O)C2=C(C=C(C=C2)OCC(C)C)O)OCCC(C)C

Isomeric SMILES

CCOC(=O)CCC1=C(C=CC(=C1)C(=O)C2=C(C=C(C=C2)OCC(C)C)O)OCCC(C)C

InChI

InChI=1S/C27H36O6/c1-6-31-26(29)12-8-20-15-21(7-11-25(20)32-14-13-18(2)3)27(30)23-10-9-22(16-24(23)28)33-17-19(4)5/h7,9-11,15-16,18-19,28H,6,8,12-14,17H2,1-5H3