5-[4-(1-benzofuran-2-yl)phenyl]-6-cyclohexyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 5-[4-(1-benzofuran-2-yl)phenyl]-6-cyclohexyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 5-[4-(benzofuran-2-yl)phenyl]-6-cyclohexyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 5-[4-(2-benzofuranyl)phenyl]-6-cyclohexyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid IUPAC Name: 5-[4-(1-benzofuran-2-yl)phenyl]-6-cyclohexyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 5-[4-(benzofuran-2-yl)phenyl]-6-cyclohexyl-7-keto-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N=C3C=C(NN3C2=O)C(=O)O)C4=CC=C(C=C4)C5=CC6=CC=CC=C6O5

Isomeric SMILES

C1CCC(CC1)C2=C(N=C3C=C(NN3C2=O)C(=O)O)C4=CC=C(C=C4)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C27H23N3O4/c31-26-24(17-6-2-1-3-7-17)25(28-23-15-20(27(32)33)29-30(23)26)18-12-10-16(11-13-18)22-14-19-8-4-5-9-21(19)34-22/h4-5,8-15,17,29H,1-3,6-7H2,(H,32,33)