3-(3-tert-butyl-5-hexyl-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 3-(3-tert-butyl-5-hexyl-4-oxidanyl-phenyl)propanoic acid Openeye Name: 3-(3-tert-butyl-5-hexyl-4-hydroxy-phenyl)propanoic acid CAS Name: 3-(3-tert-butyl-5-hexyl-4-hydroxyphenyl)propanoic acid IUPAC Name: 3-(3-tert-butyl-5-hexyl-4-hydroxyphenyl)propanoic acid Traditional Name: 3-(3-tert-butyl-5-hexyl-4-hydroxy-phenyl)propionic acid Formula: C19H30O3 MolecularWeight: 306.4397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=CC(=C1)CCC(=O)O)C(C)(C)C)O

Isomeric SMILES

CCCCCCC1=C(C(=CC(=C1)CCC(=O)O)C(C)(C)C)O

InChI

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