7-oxidanylidene-6-(oxolan-2-ylmethyl)-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 7-oxidanylidene-6-(oxolan-2-ylmethyl)-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 5-(4-benzyloxyphenyl)-7-oxo-6-(tetrahydrofuran-2-ylmethyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 7-oxo-6-(2-oxolanylmethyl)-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid IUPAC Name: 7-oxo-6-(oxolan-2-ylmethyl)-5-(4-phenylmethoxyphenyl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 5-(4-benzoxyphenyl)-7-keto-6-(tetrahydrofurfuryl)-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CC2=C(N=C3C=C(NN3C2=O)C(=O)O)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CC2=C(N=C3C=C(NN3C2=O)C(=O)O)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H23N3O5/c29-24-20(13-19-7-4-12-32-19)23(26-22-14-21(25(30)31)27-28(22)24)17-8-10-18(11-9-17)33-15-16-5-2-1-3-6-16/h1-3,5-6,8-11,14,19,27H,4,7,12-13,15H2,(H,30,31)