1,3-benzoxazol-2-ylmethyl 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: 1,3-benzoxazol-2-ylmethyl 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-phenyl-4-pyrazolecarboxylic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl 3,5-dimethyl-1-phenylpyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylic acid 1,3-benzoxazol-2-ylmethyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H17N3O3/c1-13-19(14(2)23(22-13)15-8-4-3-5-9-15)20(24)25-12-18-21-16-10-6-7-11-17(16)26-18/h3-11H,12H2,1-2H3