2-methyl-8-(2-methylpropyl)-5,6,7-tris(oxidanyl)-3-[4-(phenylsulfonyl)phenyl]chromen-4-one

Systemtic Name: 2-methyl-8-(2-methylpropyl)-5,6,7-tris(oxidanyl)-3-[4-(phenylsulfonyl)phenyl]chromen-4-one Openeye Name: 3-[4-(benzenesulfonyl)phenyl]-5,6,7-trihydroxy-8-isobutyl-2-methyl-chromen-4-one CAS Name: 3-[4-(benzenesulfonyl)phenyl]-5,6,7-trihydroxy-2-methyl-8-(2-methylpropyl)-1-benzopyran-4-one IUPAC Name: 3-[4-(benzenesulfonyl)phenyl]-5,6,7-trihydroxy-2-methyl-8-(2-methylpropyl)chromen-4-one Traditional Name: 3-(4-besylphenyl)-5,6,7-trihydroxy-8-isobutyl-2-methyl-chromone Formula: C26H24O7S MolecularWeight: 480.52956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C(=C2O)O)O)CC(C)C)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C(=C2O)O)O)CC(C)C)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H24O7S/c1-14(2)13-19-22(27)25(30)24(29)21-23(28)20(15(3)33-26(19)21)16-9-11-18(12-10-16)34(31,32)17-7-5-4-6-8-17/h4-12,14,27,29-30H,13H2,1-3H3