2-[[4-(2-iodanylethanoylamino)phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-(2-iodanylethanoylamino)phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[(2-iodoacetyl)amino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[(2-iodo-1-oxoethyl)amino]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(2-iodoacetyl)amino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[(2-iodoacetyl)amino]benzoyl]amino]glutaric acid Formula: C14H15IN2O6 MolecularWeight: 434.18317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)CI

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)CI

InChI

InChI=1S/C14H15IN2O6/c15-7-11(18)16-9-3-1-8(2-4-9)13(21)17-10(14(22)23)5-6-12(19)20/h1-4,10H,5-7H2,(H,16,18)(H,17,21)(H,19,20)(H,22,23)