2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-(2-iodanylethanoylamino)benzoic acid

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-(2-iodanylethanoylamino)benzoic acid Openeye Name: 2-(2,5-dioxopyrrolidin-1-yl)-4-[(2-iodoacetyl)amino]benzoic acid CAS Name: 2-(2,5-dioxo-1-pyrrolidinyl)-4-[(2-iodo-1-oxoethyl)amino]benzoic acid IUPAC Name: 2-(2,5-dioxopyrrolidin-1-yl)-4-[(2-iodoacetyl)amino]benzoic acid Traditional Name: 4-[(2-iodoacetyl)amino]-2-succinimido-benzoic acid Formula: C13H11IN2O5 MolecularWeight: 402.14131

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)C2=C(C=CC(=C2)NC(=O)CI)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1=O)C2=C(C=CC(=C2)NC(=O)CI)C(=O)O

InChI

InChI=1S/C13H11IN2O5/c14-6-10(17)15-7-1-2-8(13(20)21)9(5-7)16-11(18)3-4-12(16)19/h1-2,5H,3-4,6H2,(H,15,17)(H,20,21)