tert-butyl 3-methyl-5-(4-methylphenyl)-5-oxidanyl-4H-pyrazole-1-carboxylate

Systemtic Name: tert-butyl 3-methyl-5-(4-methylphenyl)-5-oxidanyl-4H-pyrazole-1-carboxylate Openeye Name: tert-butyl 5-hydroxy-3-methyl-5-(p-tolyl)-4H-pyrazole-1-carboxylate CAS Name: 5-hydroxy-3-methyl-5-(4-methylphenyl)-4H-pyrazole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-hydroxy-3-methyl-5-(4-methylphenyl)-4H-pyrazole-1-carboxylate Traditional Name: 5-hydroxy-3-methyl-5-(p-tolyl)-2-pyrazoline-1-carboxylic acid tert-butyl ester Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3/c1-11-6-8-13(9-7-11)16(20)10-12(2)17-18(16)14(19)21-15(3,4)5/h6-9,20H,10H2,1-5H3