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

Systemtic Name: 2-chloranyl-5-[5-[(Z)-[1-(4-iodophenyl)-3,5-bis(oxidanylidene)pyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid Openeye Name: 2-chloro-5-[5-[(Z)-[1-(4-iodophenyl)-3,5-dioxo-pyrazolidin-4-ylidene]methyl]-2-furyl]benzoic acid CAS Name: 2-chloro-5-[5-[(Z)-[1-(4-iodophenyl)-3,5-dioxo-4-pyrazolidinylidene]methyl]-2-furanyl]benzoic acid IUPAC Name: 2-chloro-5-[5-[(Z)-[1-(4-iodophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid Traditional Name: 2-chloro-5-[5-[(Z)-[1-(4-iodophenyl)-3,5-diketo-pyrazolidin-4-ylidene]methyl]-2-furyl]benzoic acid Formula: C21H12ClIN2O5 MolecularWeight: 534.68785

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)C(=O)N2)I

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)/C(=C\C3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)/C(=O)N2)I

InChI

InChI=1S/C21H12ClIN2O5/c22-17-7-1-11(9-15(17)21(28)29)18-8-6-14(30-18)10-16-19(26)24-25(20(16)27)13-4-2-12(23)3-5-13/h1-10H,(H,24,26)(H,28,29)/b16-10-