2-[3-ethyl-4-oxidanyl-5-(2,4,4-trimethylpentan-2-yl)phenyl]propanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)C(C)C(=O)O)C(C)(C)CC(C)(C)C)O

Isomeric SMILES

CCC1=C(C(=CC(=C1)C(C)C(=O)O)C(C)(C)CC(C)(C)C)O

InChI

InChI=1S/C19H30O3/c1-8-13-9-14(12(2)17(21)22)10-15(16(13)20)19(6,7)11-18(3,4)5/h9-10,12,20H,8,11H2,1-7H3,(H,21,22)