1,3-bis(oxidanylidene)-2-[3-[[3-oxidanylidene-2-[2,4,6-tris(chloranyl)phenyl]-1H-pyrazol-5-yl]carbamoyl]phenyl]isoindole-5-carboxylic acid

Systemtic Name: 1,3-bis(oxidanylidene)-2-[3-[[3-oxidanylidene-2-[2,4,6-tris(chloranyl)phenyl]-1H-pyrazol-5-yl]carbamoyl]phenyl]isoindole-5-carboxylic acid Openeye Name: 1,3-dioxo-2-[3-[[3-oxo-2-(2,4,6-trichlorophenyl)-1H-pyrazol-5-yl]carbamoyl]phenyl]isoindoline-5-carboxylic acid CAS Name: 1,3-dioxo-2-[3-[oxo-[[3-oxo-2-(2,4,6-trichlorophenyl)-1H-pyrazol-5-yl]amino]methyl]phenyl]-5-isoindolecarboxylic acid IUPAC Name: 1,3-dioxo-2-[3-[[3-oxo-2-(2,4,6-trichlorophenyl)-1H-pyrazol-5-yl]carbamoyl]phenyl]isoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-[3-[[5-keto-1-(2,4,6-trichlorophenyl)-3-pyrazolin-3-yl]carbamoyl]phenyl]isoindoline-5-carboxylic acid Formula: C25H13Cl3N4O6 MolecularWeight: 571.75292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)C(=O)NC4=CC(=O)N(N4)C5=C(C=C(C=C5Cl)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)C(=O)NC4=CC(=O)N(N4)C5=C(C=C(C=C5Cl)Cl)Cl

InChI

InChI=1S/C25H13Cl3N4O6/c26-13-8-17(27)21(18(28)9-13)32-20(33)10-19(30-32)29-22(34)11-2-1-3-14(6-11)31-23(35)15-5-4-12(25(37)38)7-16(15)24(31)36/h1-10,30H,(H,29,34)(H,37,38)