2-[3,4-bis(oxidanyl)phenyl]-3,5,7-trioctoxy-6-octyl-chromen-4-one

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-3,5,7-trioctoxy-6-octyl-chromen-4-one Openeye Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trioctoxy-6-octyl-chromen-4-one CAS Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trioctoxy-6-octyl-1-benzopyran-4-one IUPAC Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trioctoxy-6-octylchromen-4-one Traditional Name: 2-(3,4-dihydroxyphenyl)-3,5,7-trioctoxy-6-octyl-chromone Formula: C47H74O7 MolecularWeight: 751.08626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=C2C(=C1OCCCCCCCC)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)OCCCCCCCC)OCCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C=C2C(=C1OCCCCCCCC)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)OCCCCCCCC)OCCCCCCCC

InChI

InChI=1S/C47H74O7/c1-5-9-13-17-21-25-29-38-41(51-32-26-22-18-14-10-6-2)36-42-43(46(38)52-33-27-23-19-15-11-7-3)44(50)47(53-34-28-24-20-16-12-8-4)45(54-42)37-30-31-39(48)40(49)35-37/h30-31,35-36,48-49H,5-29,32-34H2,1-4H3