5-(2,5-dimethylphenyl)-1-(4-ethoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(2,5-dimethylphenyl)-1-(4-ethoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 5-(2,5-dimethylphenyl)-1-(4-ethoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 5-(2,5-dimethylphenyl)-1-(4-ethoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-(2,5-dimethylphenyl)-1-(4-ethoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 5-(2,5-dimethylphenyl)-1-p-phenetyl-pyrazole-3-carboxylic acid Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H20N2O3/c1-4-25-16-9-7-15(8-10-16)22-19(12-18(21-22)20(23)24)17-11-13(2)5-6-14(17)3/h5-12H,4H2,1-3H3,(H,23,24)