6-azanyl-2-[(4-iodophenyl)carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[(4-iodophenyl)carbonylamino]hexanoic acid Openeye Name: 6-amino-2-[(4-iodobenzoyl)amino]hexanoic acid CAS Name: 6-amino-2-[[(4-iodophenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[(4-iodobenzoyl)amino]hexanoic acid Traditional Name: 6-amino-2-[(4-iodobenzoyl)amino]hexanoic acid Formula: C13H17IN2O3 MolecularWeight: 376.19015

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(CCCCN)C(=O)O)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(CCCCN)C(=O)O)I

InChI

InChI=1S/C13H17IN2O3/c14-10-6-4-9(5-7-10)12(17)16-11(13(18)19)3-1-2-8-15/h4-7,11H,1-3,8,15H2,(H,16,17)(H,18,19)