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

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-6-butoxy-5,7-dimethoxy-chromen-4-one Openeye Name: 6-butoxy-2-(3,4-dihydroxyphenyl)-5,7-dimethoxy-chromen-4-one CAS Name: 6-butoxy-2-(3,4-dihydroxyphenyl)-5,7-dimethoxy-1-benzopyran-4-one IUPAC Name: 6-butoxy-2-(3,4-dihydroxyphenyl)-5,7-dimethoxychromen-4-one Traditional Name: 6-butoxy-2-(3,4-dihydroxyphenyl)-5,7-dimethoxy-chromone Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1OC)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1OC)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)OC

InChI

InChI=1S/C21H22O7/c1-4-5-8-27-20-18(25-2)11-17-19(21(20)26-3)15(24)10-16(28-17)12-6-7-13(22)14(23)9-12/h6-7,9-11,22-23H,4-5,8H2,1-3H3