2-[3,4-bis(oxidanyl)phenyl]-3-butyl-5,7,8-trimethoxy-chromen-4-one

Systemtic Name: 2-[3,4-bis(oxidanyl)phenyl]-3-butyl-5,7,8-trimethoxy-chromen-4-one Openeye Name: 3-butyl-2-(3,4-dihydroxyphenyl)-5,7,8-trimethoxy-chromen-4-one CAS Name: 3-butyl-2-(3,4-dihydroxyphenyl)-5,7,8-trimethoxy-1-benzopyran-4-one IUPAC Name: 3-butyl-2-(3,4-dihydroxyphenyl)-5,7,8-trimethoxychromen-4-one Traditional Name: 3-butyl-2-(3,4-dihydroxyphenyl)-5,7,8-trimethoxy-chromone Formula: C22H24O7 MolecularWeight: 400.42176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC2=C(C1=O)C(=CC(=C2OC)OC)OC)C3=CC(=C(C=C3)O)O

Isomeric SMILES

CCCCC1=C(OC2=C(C1=O)C(=CC(=C2OC)OC)OC)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C22H24O7/c1-5-6-7-13-19(25)18-16(26-2)11-17(27-3)21(28-4)22(18)29-20(13)12-8-9-14(23)15(24)10-12/h8-11,23-24H,5-7H2,1-4H3