(5-tert-butyl-2-phenyl-pyrazol-3-yl) 4-methoxybenzoate

Systemtic Name: (5-tert-butyl-2-phenyl-pyrazol-3-yl) 4-methoxybenzoate Openeye Name: (5-tert-butyl-2-phenyl-pyrazol-3-yl) 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (5-tert-butyl-2-phenyl-3-pyrazolyl) ester IUPAC Name: (5-tert-butyl-2-phenylpyrazol-3-yl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (5-tert-butyl-2-phenyl-pyrazol-3-yl) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3/c1-21(2,3)18-14-19(23(22-18)16-8-6-5-7-9-16)26-20(24)15-10-12-17(25-4)13-11-15/h5-14H,1-4H3