1-(1,3-benzoxazol-2-yl)-5-tert-butyl-pyrazole-3-carboxylate

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-5-tert-butyl-pyrazole-3-carboxylate Openeye Name: 1-(1,3-benzoxazol-2-yl)-5-tert-butyl-pyrazole-3-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-5-tert-butyl-3-pyrazolecarboxylate IUPAC Name: 1-(1,3-benzoxazol-2-yl)-5-tert-butylpyrazole-3-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)-5-tert-butyl-pyrazole-3-carboxylate Formula: C15H14N3O3- MolecularWeight: 284.28996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1C2=NC3=CC=CC=C3O2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=NN1C2=NC3=CC=CC=C3O2)C(=O)[O-]

InChI

InChI=1S/C15H15N3O3/c1-15(2,3)12-8-10(13(19)20)17-18(12)14-16-9-6-4-5-7-11(9)21-14/h4-8H,1-3H3,(H,19,20)/p-1