6-chloranyl-1,7-dimethyl-2-(2-phenylethynyl)pyrazolo[1,2-a]pyrazole-3,5-dione

Systemtic Name: 6-chloranyl-1,7-dimethyl-2-(2-phenylethynyl)pyrazolo[1,2-a]pyrazole-3,5-dione Openeye Name: 6-chloro-1,7-dimethyl-2-(2-phenylethynyl)pyrazolo[1,2-a]pyrazole-3,5-dione CAS Name: 6-chloro-1,7-dimethyl-2-(2-phenylethynyl)pyrazolo[1,2-a]pyrazole-3,5-dione IUPAC Name: 6-chloro-1,7-dimethyl-2-(2-phenylethynyl)pyrazolo[1,2-a]pyrazole-3,5-dione Traditional Name: 6-chloro-1,7-dimethyl-2-(2-phenylethynyl)pyrazolo[1,2-a]pyrazole-3,5-quinone Formula: C16H11ClN2O2 MolecularWeight: 298.72374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2N1C(=C(C2=O)Cl)C)C#CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N2N1C(=C(C2=O)Cl)C)C#CC3=CC=CC=C3

InChI

InChI=1S/C16H11ClN2O2/c1-10-13(9-8-12-6-4-3-5-7-12)15(20)19-16(21)14(17)11(2)18(10)19/h3-7H,1-2H3