tert-butyl (3R)-3-(4-bromophenyl)-5-methyl-3-oxidanyl-1H-pyrazole-2-carboxylate

Systemtic Name: tert-butyl (3R)-3-(4-bromophenyl)-5-methyl-3-oxidanyl-1H-pyrazole-2-carboxylate Openeye Name: tert-butyl (3R)-3-(4-bromophenyl)-3-hydroxy-5-methyl-1H-pyrazole-2-carboxylate CAS Name: (3R)-3-(4-bromophenyl)-3-hydroxy-5-methyl-1H-pyrazole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-(4-bromophenyl)-3-hydroxy-5-methyl-1H-pyrazole-2-carboxylate Traditional Name: (5R)-5-(4-bromophenyl)-5-hydroxy-3-methyl-3-pyrazoline-1-carboxylic acid tert-butyl ester Formula: C15H19BrN2O3 MolecularWeight: 355.22696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(N1)C(=O)OC(C)(C)C)(C2=CC=C(C=C2)Br)O

Isomeric SMILES

CC1=C[C@](N(N1)C(=O)OC(C)(C)C)(C2=CC=C(C=C2)Br)O

InChI

InChI=1S/C15H19BrN2O3/c1-10-9-15(20,11-5-7-12(16)8-6-11)18(17-10)13(19)21-14(2,3)4/h5-9,17,20H,1-4H3/t15-/m1/s1