1-[4-(carboniodidoylamino)phenyl]carbonyl-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonic acid

Systemtic Name: 1-[4-(carboniodidoylamino)phenyl]carbonyl-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonic acid Openeye Name: 1-[4-(iodocarbonylamino)benzoyl]-2,5-dioxo-pyrrolidine-3-sulfonic acid CAS Name: 1-[[4-(carboniodidoylamino)phenyl]-oxomethyl]-2,5-dioxo-3-pyrrolidinesulfonic acid IUPAC Name: 1-[4-(carboniodidoylamino)benzoyl]-2,5-dioxopyrrolidine-3-sulfonic acid Traditional Name: 1-[4-(iodocarbonylamino)benzoyl]-2,5-diketo-pyrrolidine-3-sulfonic acid Formula: C12H9IN2O7S MolecularWeight: 452.17853

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C(=O)C2=CC=C(C=C2)NC(=O)I)S(=O)(=O)O

Isomeric SMILES

C1C(C(=O)N(C1=O)C(=O)C2=CC=C(C=C2)NC(=O)I)S(=O)(=O)O

InChI

InChI=1S/C12H9IN2O7S/c13-12(19)14-7-3-1-6(2-4-7)10(17)15-9(16)5-8(11(15)18)23(20,21)22/h1-4,8H,5H2,(H,14,19)(H,20,21,22)