4-[diazonio-[3-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]amino]-5-iodanyl-2-oxidanyl-benzoate

Systemtic Name: 4-[diazonio-[3-oxidanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]amino]-5-iodanyl-2-oxidanyl-benzoate Openeye Name: 4-[diazonio-(3-hydroxy-2,5-dioxo-pyrrolidin-1-yl)amino]-2-hydroxy-5-iodo-benzoate CAS Name: 4-[diazonio-(3-hydroxy-2,5-dioxo-1-pyrrolidinyl)amino]-2-hydroxy-5-iodobenzoate IUPAC Name: 4-[diazonio-(3-hydroxy-2,5-dioxopyrrolidin-1-yl)amino]-2-hydroxy-5-iodobenzoate Traditional Name: 4-[diazonio-(3-hydroxy-2,5-diketo-pyrrolidino)amino]-2-hydroxy-5-iodo-benzoate Formula: C11H7IN4O6 MolecularWeight: 418.10095

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)N(C2=C(C=C(C(=C2)O)C(=O)[O-])I)[N+]#N)O

Isomeric SMILES

C1C(C(=O)N(C1=O)N(C2=C(C=C(C(=C2)O)C(=O)[O-])I)[N+]#N)O

InChI

InChI=1S/C11H7IN4O6/c12-5-1-4(11(21)22)7(17)2-6(5)16(14-13)15-9(19)3-8(18)10(15)20/h1-2,8,18H,3H2,(H-,17,21,22)