ethyl 4-[2-[(3-bromophenyl)methoxy]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(3-bromophenyl)methoxy]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(3-bromophenyl)methoxy]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[(3-bromophenyl)methoxy]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(3-bromophenyl)methoxy]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-bromobenzyl)oxybenzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H23BrN2O4 MolecularWeight: 447.32232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2OCC3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H23BrN2O4/c1-2-27-21(26)24-12-10-23(11-13-24)20(25)18-8-3-4-9-19(18)28-15-16-6-5-7-17(22)14-16/h3-9,14H,2,10-13,15H2,1H3