ethyl 4-(3,5-ditert-butylpyrazol-1-yl)benzoate

Systemtic Name: ethyl 4-(3,5-ditert-butylpyrazol-1-yl)benzoate Openeye Name: ethyl 4-(3,5-ditert-butylpyrazol-1-yl)benzoate CAS Name: 4-(3,5-ditert-butyl-1-pyrazolyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3,5-ditert-butylpyrazol-1-yl)benzoate Traditional Name: 4-(3,5-ditert-butylpyrazol-1-yl)benzoic acid ethyl ester Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C20H28N2O2/c1-8-24-18(23)14-9-11-15(12-10-14)22-17(20(5,6)7)13-16(21-22)19(2,3)4/h9-13H,8H2,1-7H3