5-(3-chlorophenyl)-7-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 5-(3-chlorophenyl)-7-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 5-(3-chlorophenyl)-7-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 5-(3-chlorophenyl)-7-(4-phenylphenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 5-(3-chlorophenyl)-7-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 5-(3-chlorophenyl)-7-(4-phenylphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C25H16ClN3O2 MolecularWeight: 425.86644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=NC4=CC(=NN34)C(=O)O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=NC4=CC(=NN34)C(=O)O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H16ClN3O2/c26-20-8-4-7-19(13-20)21-14-23(29-24(27-21)15-22(28-29)25(30)31)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h1-15H,(H,30,31)