6-(2-cyclohexylethyl)-7-oxidanylidene-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Systemtic Name: 6-(2-cyclohexylethyl)-7-oxidanylidene-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Openeye Name: 6-(2-cyclohexylethyl)-7-oxo-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid CAS Name: 6-(2-cyclohexylethyl)-7-oxo-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid IUPAC Name: 6-(2-cyclohexylethyl)-7-oxo-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Traditional Name: 6-(2-cyclohexylethyl)-7-keto-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC2=C(N=C3C=C(NN3C2=O)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)CCC2=C(N=C3C=C(NN3C2=O)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O3/c25-20-16(12-11-14-7-3-1-4-8-14)19(15-9-5-2-6-10-15)22-18-13-17(21(26)27)23-24(18)20/h2,5-6,9-10,13-14,23H,1,3-4,7-8,11-12H2,(H,26,27)