3-(3-iodanyl-4-oxidanyl-phenyl)-2-(methoxycarbonylamino)propanoic acid

Systemtic Name: 3-(3-iodanyl-4-oxidanyl-phenyl)-2-(methoxycarbonylamino)propanoic acid Openeye Name: 3-(4-hydroxy-3-iodo-phenyl)-2-(methoxycarbonylamino)propanoic acid CAS Name: 3-(4-hydroxy-3-iodophenyl)-2-(methoxycarbonylamino)propanoic acid IUPAC Name: 3-(4-hydroxy-3-iodophenyl)-2-(methoxycarbonylamino)propanoic acid Traditional Name: 2-(carbomethoxyamino)-3-(4-hydroxy-3-iodo-phenyl)propionic acid Formula: C11H12INO5 MolecularWeight: 365.12115

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CC1=CC(=C(C=C1)O)I)C(=O)O

Isomeric SMILES

COC(=O)NC(CC1=CC(=C(C=C1)O)I)C(=O)O

InChI

InChI=1S/C11H12INO5/c1-18-11(17)13-8(10(15)16)5-6-2-3-9(14)7(12)4-6/h2-4,8,14H,5H2,1H3,(H,13,17)(H,15,16)