5,7-bis(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 5,7-bis(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 5,7-bis(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 5,7-bis(4-phenoxyphenyl)-2-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 5,7-bis(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 5,7-bis(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C31H21N3O4 MolecularWeight: 499.51614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC(=NC4=CC(=NN34)C(=O)O)C5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=CC(=NC4=CC(=NN34)C(=O)O)C5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C31H21N3O4/c35-31(36)28-20-30-32-27(21-11-15-25(16-12-21)37-23-7-3-1-4-8-23)19-29(34(30)33-28)22-13-17-26(18-14-22)38-24-9-5-2-6-10-24/h1-20H,(H,35,36)