5-bromanyl-2-[5-[(Z)-[1-(4-iodophenyl)-3,5-bis(oxidanylidene)pyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate

Systemtic Name: 5-bromanyl-2-[5-[(Z)-[1-(4-iodophenyl)-3,5-bis(oxidanylidene)pyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate Openeye Name: 5-bromo-2-[5-[(Z)-[1-(4-iodophenyl)-3,5-dioxo-pyrazolidin-4-ylidene]methyl]-2-furyl]benzoate CAS Name: 5-bromo-2-[5-[(Z)-[1-(4-iodophenyl)-3,5-dioxo-4-pyrazolidinylidene]methyl]-2-furanyl]benzoate IUPAC Name: 5-bromo-2-[5-[(Z)-[1-(4-iodophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoate Traditional Name: 5-bromo-2-[5-[(Z)-[1-(4-iodophenyl)-3,5-diketo-pyrazolidin-4-ylidene]methyl]-2-furyl]benzoate Formula: C21H11BrIN2O5- MolecularWeight: 578.13091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)Br)C(=O)[O-])C(=O)N2)I

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)/C(=C\C3=CC=C(O3)C4=C(C=C(C=C4)Br)C(=O)[O-])/C(=O)N2)I

InChI

InChI=1S/C21H12BrIN2O5/c22-11-1-7-15(16(9-11)21(28)29)18-8-6-14(30-18)10-17-19(26)24-25(20(17)27)13-4-2-12(23)3-5-13/h1-10H,(H,24,26)(H,28,29)/p-1/b17-10-