6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: 6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: 6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarboxylate IUPAC Name: 6-[(2,5-dimethylphenyl)methyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-(2,5-dimethylbenzyl)-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxylate Formula: C18H18N3O2- MolecularWeight: 308.35442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(N3C(=C(C=N3)C(=O)[O-])N=C2C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(N3C(=C(C=N3)C(=O)[O-])N=C2C)C

InChI

InChI=1S/C18H19N3O2/c1-10-5-6-11(2)14(7-10)8-15-12(3)20-17-16(18(22)23)9-19-21(17)13(15)4/h5-7,9H,8H2,1-4H3,(H,22,23)/p-1