3-octoxy-2-oxidanyl-5-(4-oxidanylbutoxy)chromen-4-one

Systemtic Name: 3-octoxy-2-oxidanyl-5-(4-oxidanylbutoxy)chromen-4-one Openeye Name: 2-hydroxy-5-(4-hydroxybutoxy)-3-octoxy-chromen-4-one CAS Name: 2-hydroxy-5-(4-hydroxybutoxy)-3-octoxy-1-benzopyran-4-one IUPAC Name: 2-hydroxy-5-(4-hydroxybutoxy)-3-octoxychromen-4-one Traditional Name: 2-hydroxy-5-(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/c1-2-3-4-5-6-8-15-26-20-19(23)18-16(25-14-9-7-13-22)11-10-12-17(18)27-21(20)24/h10-12,22,24H,2-9,13-15H2,1H3