tert-butyl 4-[(3-chlorophenyl)methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-chlorophenyl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(3-chlorophenyl)methyl]piperazine-1-carboxylate CAS Name: 4-[(3-chlorophenyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-chlorophenyl)methyl]piperazine-1-carboxylate Traditional Name: 4-(3-chlorobenzyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H23ClN2O2 MolecularWeight: 310.81902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H23ClN2O2/c1-16(2,3)21-15(20)19-9-7-18(8-10-19)12-13-5-4-6-14(17)11-13/h4-6,11H,7-10,12H2,1-3H3