tert-butyl 4-(4-bromanyl-2-oxidanyl-phenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-bromanyl-2-oxidanyl-phenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-bromo-2-hydroxy-phenyl)piperazine-1-carboxylate CAS Name: 4-(4-bromo-2-hydroxyphenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-bromo-2-hydroxyphenyl)piperazine-1-carboxylate Traditional Name: 4-(4-bromo-2-hydroxy-phenyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C15H21BrN2O3 MolecularWeight: 357.24284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Br)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Br)O

InChI

InChI=1S/C15H21BrN2O3/c1-15(2,3)21-14(20)18-8-6-17(7-9-18)12-5-4-11(16)10-13(12)19/h4-5,10,19H,6-9H2,1-3H3