3-methyl-5-(3-methylbutanoyl)-2,4,6-tris(oxidanyl)benzaldehyde

Systemtic Name: 3-methyl-5-(3-methylbutanoyl)-2,4,6-tris(oxidanyl)benzaldehyde Openeye Name: 2,4,6-trihydroxy-3-methyl-5-(3-methylbutanoyl)benzaldehyde CAS Name: 2,4,6-trihydroxy-3-methyl-5-(3-methyl-1-oxobutyl)benzaldehyde IUPAC Name: 2,4,6-trihydroxy-3-methyl-5-(3-methylbutanoyl)benzaldehyde Traditional Name: 2,4,6-trihydroxy-3-isovaleryl-5-methyl-benzaldehyde Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1O)C(=O)CC(C)C)O)C=O)O

Isomeric SMILES

CC1=C(C(=C(C(=C1O)C(=O)CC(C)C)O)C=O)O

InChI

InChI=1S/C13H16O5/c1-6(2)4-9(15)10-12(17)7(3)11(16)8(5-14)13(10)18/h5-6,16-18H,4H2,1-3H3