2-[(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)methyl]propanedioate

Systemtic Name: 2-[(3-tert-butyl-5-methyl-4-oxidanyl-phenyl)methyl]propanedioate Openeye Name: 2-[(3-tert-butyl-4-hydroxy-5-methyl-phenyl)methyl]propanedioate CAS Name: 2-[(3-tert-butyl-4-hydroxy-5-methylphenyl)methyl]propanedioate IUPAC Name: 2-[(3-tert-butyl-4-hydroxy-5-methylphenyl)methyl]propanedioate Traditional Name: 2-(3-tert-butyl-4-hydroxy-5-methyl-benzyl)malonate Formula: C15H18O5-2 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(C(=O)[O-])C(=O)[O-])C(C)(C)C)O

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(C(=O)[O-])C(=O)[O-])C(C)(C)C)O

InChI

InChI=1S/C15H20O5/c1-8-5-9(6-10(13(17)18)14(19)20)7-11(12(8)16)15(2,3)4/h5,7,10,16H,6H2,1-4H3,(H,17,18)(H,19,20)/p-2