6-[2-[[4-[(2-iodanylphenyl)carbonylamino]phenyl]carbonyl-methyl-amino]phenoxy]hexanoic acid

Systemtic Name: 6-[2-[[4-[(2-iodanylphenyl)carbonylamino]phenyl]carbonyl-methyl-amino]phenoxy]hexanoic acid Openeye Name: 6-[2-[[4-[(2-iodobenzoyl)amino]benzoyl]-methyl-amino]phenoxy]hexanoic acid CAS Name: 6-[2-[[[4-[[(2-iodophenyl)-oxomethyl]amino]phenyl]-oxomethyl]-methylamino]phenoxy]hexanoic acid IUPAC Name: 6-[2-[[4-[(2-iodobenzoyl)amino]benzoyl]-methylamino]phenoxy]hexanoic acid Traditional Name: 6-[2-[[4-[(2-iodobenzoyl)amino]benzoyl]-methyl-amino]phenoxy]hexanoic acid Formula: C27H27IN2O5 MolecularWeight: 586.41815

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1OCCCCCC(=O)O)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CN(C1=CC=CC=C1OCCCCCC(=O)O)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C27H27IN2O5/c1-30(23-11-6-7-12-24(23)35-18-8-2-3-13-25(31)32)27(34)19-14-16-20(17-15-19)29-26(33)21-9-4-5-10-22(21)28/h4-7,9-12,14-17H,2-3,8,13,18H2,1H3,(H,29,33)(H,31,32)