2-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoic acid

Systemtic Name: 2-[1-(4-iodophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylpropanoic acid Openeye Name: 2-[1-(4-iodophenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanylpropanoic acid CAS Name: 2-[[1-(4-iodophenyl)-2,5-dioxo-3-pyrrolidinyl]thio]propanoic acid IUPAC Name: 2-[1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpropanoic acid Traditional Name: 2-[[1-(4-iodophenyl)-2,5-diketo-pyrrolidin-3-yl]thio]propionic acid Formula: C13H12INO4S MolecularWeight: 405.20815

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1CC(=O)N(C1=O)C2=CC=C(C=C2)I

Isomeric SMILES

CC(C(=O)O)SC1CC(=O)N(C1=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C13H12INO4S/c1-7(13(18)19)20-10-6-11(16)15(12(10)17)9-4-2-8(14)3-5-9/h2-5,7,10H,6H2,1H3,(H,18,19)