2-(4-chlorophenyl)-8-(3-methyl-3-oxidanyl-butyl)-3,5,7-tris(oxidanyl)chromen-4-one

Systemtic Name: 2-(4-chlorophenyl)-8-(3-methyl-3-oxidanyl-butyl)-3,5,7-tris(oxidanyl)chromen-4-one Openeye Name: 2-(4-chlorophenyl)-3,5,7-trihydroxy-8-(3-hydroxy-3-methyl-butyl)chromen-4-one CAS Name: 2-(4-chlorophenyl)-3,5,7-trihydroxy-8-(3-hydroxy-3-methylbutyl)-1-benzopyran-4-one IUPAC Name: 2-(4-chlorophenyl)-3,5,7-trihydroxy-8-(3-hydroxy-3-methylbutyl)chromen-4-one Traditional Name: 2-(4-chlorophenyl)-3,5,7-trihydroxy-8-(3-hydroxy-3-methyl-butyl)chromone Formula: C20H19ClO6 MolecularWeight: 390.81426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=C(C=C(C2=C1OC(=C(C2=O)O)C3=CC=C(C=C3)Cl)O)O)O

Isomeric SMILES

CC(C)(CCC1=C(C=C(C2=C1OC(=C(C2=O)O)C3=CC=C(C=C3)Cl)O)O)O

InChI

InChI=1S/C20H19ClO6/c1-20(2,26)8-7-12-13(22)9-14(23)15-16(24)17(25)18(27-19(12)15)10-3-5-11(21)6-4-10/h3-6,9,22-23,25-26H,7-8H2,1-2H3