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

Systemtic Name: tert-butyl 4-[(4-cyanophenyl)methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(4-cyanophenyl)methyl]piperazine-1-carboxylate CAS Name: 4-[(4-cyanophenyl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-cyanophenyl)methyl]piperazine-1-carboxylate Traditional Name: 4-(4-cyanobenzyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C17H23N3O2 MolecularWeight: 301.38342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H23N3O2/c1-17(2,3)22-16(21)20-10-8-19(9-11-20)13-15-6-4-14(12-18)5-7-15/h4-7H,8-11,13H2,1-3H3