3-octoxy-2-oxidanyl-7-(4-oxidanylbutoxy)chromen-4-one

Systemtic Name: 3-octoxy-2-oxidanyl-7-(4-oxidanylbutoxy)chromen-4-one Openeye Name: 2-hydroxy-7-(4-hydroxybutoxy)-3-octoxy-chromen-4-one CAS Name: 2-hydroxy-7-(4-hydroxybutoxy)-3-octoxy-1-benzopyran-4-one IUPAC Name: 2-hydroxy-7-(4-hydroxybutoxy)-3-octoxychromen-4-one Traditional Name: 2-hydroxy-7-(4-hydroxybutoxy)-3-octoxy-chromone Formula: C21H30O6 MolecularWeight: 378.4593

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)OCCCCO)O

Isomeric SMILES

CCCCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)OCCCCO)O

InChI

InChI=1S/C21H30O6/c1-2-3-4-5-6-8-14-26-20-19(23)17-11-10-16(25-13-9-7-12-22)15-18(17)27-21(20)24/h10-11,15,22,24H,2-9,12-14H2,1H3