3-[3-azanyl-2,4,6-tris(iodanyl)phenyl]pentanedioic acid

Systemtic Name: 3-[3-azanyl-2,4,6-tris(iodanyl)phenyl]pentanedioic acid Openeye Name: 3-(3-amino-2,4,6-triiodo-phenyl)pentanedioic acid CAS Name: 3-(3-amino-2,4,6-triiodophenyl)pentanedioic acid IUPAC Name: 3-(3-amino-2,4,6-triiodophenyl)pentanedioic acid Traditional Name: 3-(3-amino-2,4,6-triiodo-phenyl)glutaric acid Formula: C11H10I3NO4 MolecularWeight: 600.91481

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1I)N)I)C(CC(=O)O)CC(=O)O)I

Isomeric SMILES

C1=C(C(=C(C(=C1I)N)I)C(CC(=O)O)CC(=O)O)I

InChI

InChI=1S/C11H10I3NO4/c12-5-3-6(13)11(15)10(14)9(5)4(1-7(16)17)2-8(18)19/h3-4H,1-2,15H2,(H,16,17)(H,18,19)