| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)Cc2cc(I)c(Oc1cc(I)c(O)cc1)c(I)c2 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O |
| SMILES | CACTVS | 3.341 | N[CH](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1Oc2c(cc(cc2I)C[C@@H](C(=O)O)N)I)I)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1Oc2c(cc(cc2I)CC(C(=O)O)N)I)I)O |
| InChI | InChI | 1.03 | InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1 |
| InChIKey | InChI | 1.03 | AUYYCJSJGJYCDS-LBPRGKRZSA-N |
