3-[1-(5-carboxy-3-methyl-2-oxidanyl-phenyl)-3,5,5-trimethyl-hexyl]-5-methyl-4-oxidanyl-benzoic acid

Systemtic Name: 3-[1-(5-carboxy-3-methyl-2-oxidanyl-phenyl)-3,5,5-trimethyl-hexyl]-5-methyl-4-oxidanyl-benzoic acid Openeye Name: 3-[1-(5-carboxy-2-hydroxy-3-methyl-phenyl)-3,5,5-trimethyl-hexyl]-4-hydroxy-5-methyl-benzoic acid CAS Name: 3-[1-(5-carboxy-2-hydroxy-3-methylphenyl)-3,5,5-trimethylhexyl]-4-hydroxy-5-methylbenzoic acid IUPAC Name: 3-[1-(5-carboxy-2-hydroxy-3-methylphenyl)-3,5,5-trimethylhexyl]-4-hydroxy-5-methylbenzoic acid Traditional Name: 3-[1-(5-carboxy-2-hydroxy-3-methyl-phenyl)-3,5,5-trimethyl-hexyl]-4-hydroxy-5-methyl-benzoic acid Formula: C25H32O6 MolecularWeight: 428.51798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)C(CC(C)CC(C)(C)C)C2=CC(=CC(=C2O)C)C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)C(CC(C)CC(C)(C)C)C2=CC(=CC(=C2O)C)C(=O)O)O

InChI

InChI=1S/C25H32O6/c1-13(12-25(4,5)6)7-18(19-10-16(23(28)29)8-14(2)21(19)26)20-11-17(24(30)31)9-15(3)22(20)27/h8-11,13,18,26-27H,7,12H2,1-6H3,(H,28,29)(H,30,31)