1-(4-isocyanatophenyl)-4-pyridin-2-yl-piperazine

Systemtic Name: 1-(4-isocyanatophenyl)-4-pyridin-2-yl-piperazine Openeye Name: 1-(4-isocyanatophenyl)-4-(2-pyridyl)piperazine CAS Name: 1-(4-isocyanatophenyl)-4-(2-pyridinyl)piperazine IUPAC Name: 1-(4-isocyanatophenyl)-4-pyridin-2-ylpiperazine Traditional Name: 1-(4-isocyanatophenyl)-4-(2-pyridyl)piperazine Formula: C16H16N4O MolecularWeight: 280.32444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)N=C=O)C3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)N=C=O)C3=CC=CC=N3

InChI

InChI=1S/C16H16N4O/c21-13-18-14-4-6-15(7-5-14)19-9-11-20(12-10-19)16-3-1-2-8-17-16/h1-8H,9-12H2