2-[3-iodanyl-5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]prop-2-enoic acid

Systemtic Name: 2-[3-iodanyl-5-(2-methylbutan-2-yl)-2-oxidanyl-phenyl]prop-2-enoic acid Openeye Name: 2-[5-(1,1-dimethylpropyl)-2-hydroxy-3-iodo-phenyl]prop-2-enoic acid CAS Name: 2-[2-hydroxy-3-iodo-5-(2-methylbutan-2-yl)phenyl]-2-propenoic acid IUPAC Name: 2-[2-hydroxy-3-iodo-5-(2-methylbutan-2-yl)phenyl]prop-2-enoic acid Traditional Name: 2-(5-tert-amyl-2-hydroxy-3-iodo-phenyl)acrylic acid Formula: C14H17IO3 MolecularWeight: 360.18745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17IO3/c1-5-14(3,4)9-6-10(8(2)13(17)18)12(16)11(15)7-9/h6-7,16H,2,5H2,1,3-4H3,(H,17,18)