N,1,2-tris(3,4-dichlorophenyl)-3-oxidanyl-5-oxidanylidene-pyrazole-4-carboxamide

Systemtic Name: N,1,2-tris(3,4-dichlorophenyl)-3-oxidanyl-5-oxidanylidene-pyrazole-4-carboxamide Openeye Name: N,1,2-tris(3,4-dichlorophenyl)-3-hydroxy-5-oxo-pyrazole-4-carboxamide CAS Name: N,1,2-tris(3,4-dichlorophenyl)-3-hydroxy-5-oxo-4-pyrazolecarboxamide IUPAC Name: N,1,2-tris(3,4-dichlorophenyl)-3-hydroxy-5-oxopyrazole-4-carboxamide Traditional Name: N,1,2-tris(3,4-dichlorophenyl)-3-hydroxy-5-keto-3-pyrazoline-4-carboxamide Formula: C22H11Cl6N3O3 MolecularWeight: 578.05904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=C(N(N(C2=O)C3=CC(=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)Cl)Cl)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=C(N(N(C2=O)C3=CC(=C(C=C3)Cl)Cl)C4=CC(=C(C=C4)Cl)Cl)O)Cl)Cl

InChI

InChI=1S/C22H11Cl6N3O3/c23-13-4-1-10(7-16(13)26)29-20(32)19-21(33)30(11-2-5-14(24)17(27)8-11)31(22(19)34)12-3-6-15(25)18(28)9-12/h1-9,33H,(H,29,32)