2-[(4E)-4-(furan-2-ylmethylidene)-3,5-bis(oxidanylidene)pyrazolidin-1-yl]-5-iodanyl-benzoic acid

Systemtic Name: 2-[(4E)-4-(furan-2-ylmethylidene)-3,5-bis(oxidanylidene)pyrazolidin-1-yl]-5-iodanyl-benzoic acid Openeye Name: 2-[(4E)-4-(2-furylmethylene)-3,5-dioxo-pyrazolidin-1-yl]-5-iodo-benzoic acid CAS Name: 2-[(4E)-4-(2-furanylmethylidene)-3,5-dioxo-1-pyrazolidinyl]-5-iodobenzoic acid IUPAC Name: 2-[(4E)-4-(furan-2-ylmethylidene)-3,5-dioxopyrazolidin-1-yl]-5-iodobenzoic acid Traditional Name: 2-[(4E)-4-(2-furfurylidene)-3,5-diketo-pyrazolidin-1-yl]-5-iodo-benzoic acid Formula: C15H9IN2O5 MolecularWeight: 424.14683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=C2C(=O)NN(C2=O)C3=C(C=C(C=C3)I)C(=O)O

Isomeric SMILES

C1=COC(=C1)/C=C/2\C(=O)NN(C2=O)C3=C(C=C(C=C3)I)C(=O)O

InChI

InChI=1S/C15H9IN2O5/c16-8-3-4-12(10(6-8)15(21)22)18-14(20)11(13(19)17-18)7-9-2-1-5-23-9/h1-7H,(H,17,19)(H,21,22)/b11-7+