5-nitro-2-(4-pyridin-2-ylpiperazin-1-yl)benzaldehyde

Systemtic Name: 5-nitro-2-(4-pyridin-2-ylpiperazin-1-yl)benzaldehyde Openeye Name: 5-nitro-2-[4-(2-pyridyl)piperazin-1-yl]benzaldehyde CAS Name: 5-nitro-2-[4-(2-pyridinyl)-1-piperazinyl]benzaldehyde IUPAC Name: 5-nitro-2-(4-pyridin-2-ylpiperazin-1-yl)benzaldehyde Traditional Name: 5-nitro-2-[4-(2-pyridyl)piperazino]benzaldehyde Formula: C16H16N4O3 MolecularWeight: 312.32324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=O)C3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=O)C3=CC=CC=N3

InChI

InChI=1S/C16H16N4O3/c21-12-13-11-14(20(22)23)4-5-15(13)18-7-9-19(10-8-18)16-3-1-2-6-17-16/h1-6,11-12H,7-10H2