3-[2,3-dimethyl-5-(2-methylheptan-2-yl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 3-[2,3-dimethyl-5-(2-methylheptan-2-yl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 3-[5-(1,1-dimethylhexyl)-4-hydroxy-2,3-dimethyl-phenyl]propanoic acid CAS Name: 3-[4-hydroxy-2,3-dimethyl-5-(2-methylheptan-2-yl)phenyl]propanoic acid IUPAC Name: 3-[4-hydroxy-2,3-dimethyl-5-(2-methylheptan-2-yl)phenyl]propanoic acid Traditional Name: 3-[5-(1,1-dimethylhexyl)-4-hydroxy-2,3-dimethyl-phenyl]propionic acid Formula: C19H30O3 MolecularWeight: 306.4397

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=C(C(=C(C(=C1)CCC(=O)O)C)C)O

Isomeric SMILES

CCCCCC(C)(C)C1=C(C(=C(C(=C1)CCC(=O)O)C)C)O

InChI

InChI=1S/C19H30O3/c1-6-7-8-11-19(4,5)16-12-15(9-10-17(20)21)13(2)14(3)18(16)22/h12,22H,6-11H2,1-5H3,(H,20,21)