5-[[3,5-bis(oxidanylidene)pyrazolidin-4-ylidene]-(4-iodophenyl)methyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[3,5-bis(oxidanylidene)pyrazolidin-4-ylidene]-(4-iodophenyl)methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[(3,5-dioxopyrazolidin-4-ylidene)-(4-iodophenyl)methyl]-2-hydroxy-benzoic acid CAS Name: 5-[(3,5-dioxo-4-pyrazolidinylidene)-(4-iodophenyl)methyl]-2-hydroxybenzoic acid IUPAC Name: 5-[(3,5-dioxopyrazolidin-4-ylidene)-(4-iodophenyl)methyl]-2-hydroxybenzoic acid Traditional Name: 5-[(3,5-diketopyrazolidin-4-ylidene)-(4-iodophenyl)methyl]-2-hydroxy-benzoic acid Formula: C17H11IN2O5 MolecularWeight: 450.18411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=C2C(=O)NNC2=O)C3=CC(=C(C=C3)O)C(=O)O)I

Isomeric SMILES

C1=CC(=CC=C1C(=C2C(=O)NNC2=O)C3=CC(=C(C=C3)O)C(=O)O)I

InChI

InChI=1S/C17H11IN2O5/c18-10-4-1-8(2-5-10)13(14-15(22)19-20-16(14)23)9-3-6-12(21)11(7-9)17(24)25/h1-7,21H,(H,19,22)(H,20,23)(H,24,25)