5-(2-tert-butylphenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-(2-tert-butylphenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-(2-tert-butylphenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-(2-tert-butylphenoxy)-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(2-tert-butylphenoxy)-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 5-(2-tert-butylphenoxy)-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)OC2=CC=CC=C2C(C)(C)C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)OC2=CC=CC=C2C(C)(C)C)C

InChI

InChI=1S/C16H20N2O3/c1-10-13(15(19)20)14(18(5)17-10)21-12-9-7-6-8-11(12)16(2,3)4/h6-9H,1-5H3,(H,19,20)