3-(4-chlorophenyl)-6-(2-hydroxyethyl)-2-methyl-7-oxidanidyl-pyrazolo[1,5-a]pyrimidine-5-carboxylate

Systemtic Name: 3-(4-chlorophenyl)-6-(2-hydroxyethyl)-2-methyl-7-oxidanidyl-pyrazolo[1,5-a]pyrimidine-5-carboxylate Openeye Name: 3-(4-chlorophenyl)-6-(2-hydroxyethyl)-2-methyl-7-oxido-pyrazolo[1,5-a]pyrimidine-5-carboxylate CAS Name: 3-(4-chlorophenyl)-6-(2-hydroxyethyl)-2-methyl-7-oxido-5-pyrazolo[1,5-a]pyrimidinecarboxylate IUPAC Name: 3-(4-chlorophenyl)-6-(2-hydroxyethyl)-2-methyl-7-oxidopyrazolo[1,5-a]pyrimidine-5-carboxylate Traditional Name: 3-(4-chlorophenyl)-6-(2-hydroxyethyl)-2-methyl-7-oxido-pyrazolo[1,5-a]pyrimidine-5-carboxylate Formula: C16H12ClN3O4-2 MolecularWeight: 345.73718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=C1C3=CC=C(C=C3)Cl)N=C(C(=C2[O-])CCO)C(=O)[O-]

Isomeric SMILES

CC1=NN2C(=C1C3=CC=C(C=C3)Cl)N=C(C(=C2[O-])CCO)C(=O)[O-]

InChI

InChI=1S/C16H14ClN3O4/c1-8-12(9-2-4-10(17)5-3-9)14-18-13(16(23)24)11(6-7-21)15(22)20(14)19-8/h2-5,21-22H,6-7H2,1H3,(H,23,24)/p-2