tert-butyl 4-(3-isocyanophenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-isocyanophenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-isocyanophenyl)piperazine-1-carboxylate CAS Name: 4-(3-isocyanophenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-isocyanophenyl)piperazine-1-carboxylate Traditional Name: 4-(3-isocyanophenyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H21N3O2 MolecularWeight: 287.35684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC(=C2)[N+]#[C-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC(=C2)[N+]#[C-]

InChI

InChI=1S/C16H21N3O2/c1-16(2,3)21-15(20)19-10-8-18(9-11-19)14-7-5-6-13(12-14)17-4/h5-7,12H,8-11H2,1-3H3