5-chloranyl-2-nitro-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide

Systemtic Name: 5-chloranyl-2-nitro-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide Openeye Name: 5-chloro-2-nitro-N-[4-[6-(1-piperidyl)pyridazin-3-yl]phenyl]benzamide CAS Name: 5-chloro-2-nitro-N-[4-[6-(1-piperidinyl)-3-pyridazinyl]phenyl]benzamide IUPAC Name: 5-chloro-2-nitro-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide Traditional Name: 5-chloro-2-nitro-N-[4-(6-piperidinopyridazin-3-yl)phenyl]benzamide Formula: C22H20ClN5O3 MolecularWeight: 437.8789

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN5O3/c23-16-6-10-20(28(30)31)18(14-16)22(29)24-17-7-4-15(5-8-17)19-9-11-21(26-25-19)27-12-2-1-3-13-27/h4-11,14H,1-3,12-13H2,(H,24,29)