ethyl 4-(3-bromanyl-4-methoxy-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-bromanyl-4-methoxy-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3-bromo-4-methoxy-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-bromo-4-methoxyphenyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromo-4-methoxybenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-bromo-4-methoxy-benzoyl)piperazine-1-carboxylic acid ethyl ester Formula: C15H19BrN2O4 MolecularWeight: 371.22636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19BrN2O4/c1-3-22-15(20)18-8-6-17(7-9-18)14(19)11-4-5-13(21-2)12(16)10-11/h4-5,10H,3,6-9H2,1-2H3