4-(3,5-ditert-butylpyrazol-1-yl)benzoic acid

Systemtic Name: 4-(3,5-ditert-butylpyrazol-1-yl)benzoic acid Openeye Name: 4-(3,5-ditert-butylpyrazol-1-yl)benzoic acid CAS Name: 4-(3,5-ditert-butyl-1-pyrazolyl)benzoic acid IUPAC Name: 4-(3,5-ditert-butylpyrazol-1-yl)benzoic acid Traditional Name: 4-(3,5-ditert-butylpyrazol-1-yl)benzoic acid Formula: C18H24N2O2 MolecularWeight: 300.39536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1C2=CC=C(C=C2)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=NN1C2=CC=C(C=C2)C(=O)O)C(C)(C)C

InChI

InChI=1S/C18H24N2O2/c1-17(2,3)14-11-15(18(4,5)6)20(19-14)13-9-7-12(8-10-13)16(21)22/h7-11H,1-6H3,(H,21,22)