ethyl 4-[2-fluoranyl-4-(phenylcarbonyl)phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-fluoranyl-4-(phenylcarbonyl)phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(4-benzoyl-2-fluoro-phenyl)piperazine-1-carboxylate CAS Name: 4-(4-benzoyl-2-fluorophenyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-benzoyl-2-fluorophenyl)piperazine-1-carboxylate Traditional Name: 4-(4-benzoyl-2-fluoro-phenyl)piperazine-1-carboxylic acid ethyl ester Formula: C20H21FN2O3 MolecularWeight: 356.390743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)F

InChI

InChI=1S/C20H21FN2O3/c1-2-26-20(25)23-12-10-22(11-13-23)18-9-8-16(14-17(18)21)19(24)15-6-4-3-5-7-15/h3-9,14H,2,10-13H2,1H3