tert-butyl 3-methyl-5-phenyl-pyrazole-1-carboxylate

Systemtic Name: tert-butyl 3-methyl-5-phenyl-pyrazole-1-carboxylate Openeye Name: tert-butyl 3-methyl-5-phenyl-pyrazole-1-carboxylate CAS Name: 3-methyl-5-phenyl-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-methyl-5-phenylpyrazole-1-carboxylate Traditional Name: 3-methyl-5-phenyl-pyrazole-1-carboxylic acid tert-butyl ester Formula: C15H18N2O2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H18N2O2/c1-11-10-13(12-8-6-5-7-9-12)17(16-11)14(18)19-15(2,3)4/h5-10H,1-4H3