5-iodanyl-2-(2-methylpropanoylamino)benzoic acid

Systemtic Name: 5-iodanyl-2-(2-methylpropanoylamino)benzoic acid Openeye Name: 5-iodo-2-(2-methylpropanoylamino)benzoic acid CAS Name: 5-iodo-2-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 5-iodo-2-(2-methylpropanoylamino)benzoic acid Traditional Name: 5-iodo-2-(isobutyrylamino)benzoic acid Formula: C11H12INO3 MolecularWeight: 333.12235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C=C1)I)C(=O)O

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)I)C(=O)O

InChI

InChI=1S/C11H12INO3/c1-6(2)10(14)13-9-4-3-7(12)5-8(9)11(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)