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

Systemtic Name: 2-chloranyl-4-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide CAS Name: 2-chloro-4-nitro-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]benzamide Traditional Name: 2-chloro-4-nitro-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]benzamide Formula: C21H18ClN5O3 MolecularWeight: 423.85232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H18ClN5O3/c22-18-13-16(27(29)30)6-7-17(18)21(28)23-15-5-3-4-14(12-15)19-8-9-20(25-24-19)26-10-1-2-11-26/h3-9,12-13H,1-2,10-11H2,(H,23,28)