1-(4-chlorophenyl)-5-methyl-7-oxidanylidene-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid

Systemtic Name: 1-(4-chlorophenyl)-5-methyl-7-oxidanylidene-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid Openeye Name: 1-(4-chlorophenyl)-5-methyl-7-oxo-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid CAS Name: 1-(4-chlorophenyl)-5-methyl-7-oxo-6-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 1-(4-chlorophenyl)-5-methyl-7-oxopyrazolo[1,5-a]pyrimidine-6-carboxylic acid Traditional Name: 1-(4-chlorophenyl)-7-keto-5-methyl-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid Formula: C14H10ClN3O3 MolecularWeight: 303.7005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C=CN2C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C=CN2C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C14H10ClN3O3/c1-8-12(14(20)21)13(19)18-11(16-8)6-7-17(18)10-4-2-9(15)3-5-10/h2-7H,1H3,(H,20,21)