7-cyclohexyl-6-(4-propoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid

Systemtic Name: 7-cyclohexyl-6-(4-propoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Openeye Name: 7-cyclohexyl-6-(4-propoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid CAS Name: 7-cyclohexyl-6-(4-propoxyphenyl)-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid IUPAC Name: 7-cyclohexyl-6-(4-propoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Traditional Name: 7-cyclohexyl-6-(4-propoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=C(N3C(=C(C=N3)C(=O)O)N=C2)C4CCCCC4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=C(N3C(=C(C=N3)C(=O)O)N=C2)C4CCCCC4

InChI

InChI=1S/C22H25N3O3/c1-2-12-28-17-10-8-15(9-11-17)18-13-23-21-19(22(26)27)14-24-25(21)20(18)16-6-4-3-5-7-16/h8-11,13-14,16H,2-7,12H2,1H3,(H,26,27)