tert-butyl 4-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-bromo-3,5-dimethoxy-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-bromo-3,5-dimethoxybenzoyl)piperazine-1-carboxylate Traditional Name: 4-(4-bromo-3,5-dimethoxy-benzoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H25BrN2O5 MolecularWeight: 429.3055

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25BrN2O5/c1-18(2,3)26-17(23)21-8-6-20(7-9-21)16(22)12-10-13(24-4)15(19)14(11-12)25-5/h10-11H,6-9H2,1-5H3