ethyl 3-[7-[3-(2-butyl-4-ethanoyl-3-oxidanyl-phenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-8-propyl-chromen-2-yl]propanoate

Systemtic Name: ethyl 3-[7-[3-(2-butyl-4-ethanoyl-3-oxidanyl-phenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-8-propyl-chromen-2-yl]propanoate Openeye Name: ethyl 3-[7-[3-(4-acetyl-2-butyl-3-hydroxy-phenoxy)-2-hydroxy-propoxy]-4-oxo-8-propyl-chromen-2-yl]propanoate CAS Name: 3-[7-[3-(4-acetyl-2-butyl-3-hydroxyphenoxy)-2-hydroxypropoxy]-4-oxo-8-propyl-1-benzopyran-2-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[7-[3-(4-acetyl-2-butyl-3-hydroxyphenoxy)-2-hydroxypropoxy]-4-oxo-8-propylchromen-2-yl]propanoate Traditional Name: 3-[7-[3-(4-acetyl-2-butyl-3-hydroxy-phenoxy)-2-hydroxy-propoxy]-4-keto-8-propyl-chromen-2-yl]propionic acid ethyl ester Formula: C32H40O9 MolecularWeight: 568.6546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=C(C3=C(C=C2)C(=O)C=C(O3)CCC(=O)OCC)CCC)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=C(C3=C(C=C2)C(=O)C=C(O3)CCC(=O)OCC)CCC)O

InChI

InChI=1S/C32H40O9/c1-5-8-10-25-28(14-12-23(20(4)33)31(25)37)39-18-21(34)19-40-29-15-13-24-27(35)17-22(11-16-30(36)38-7-3)41-32(24)26(29)9-6-2/h12-15,17,21,34,37H,5-11,16,18-19H2,1-4H3