2-(methylamino)-5-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide

Systemtic Name: 2-(methylamino)-5-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Openeye Name: 2-(methylamino)-5-nitro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide CAS Name: 2-(methylamino)-5-nitro-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]benzamide IUPAC Name: 2-(methylamino)-5-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Traditional Name: 2-(methylamino)-5-nitro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide Formula: C21H16N4O3 MolecularWeight: 372.37674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3

InChI

InChI=1S/C21H16N4O3/c1-22-20-11-10-18(25(27)28)14-19(20)21(26)24-17-7-4-5-15(13-17)8-9-16-6-2-3-12-23-16/h2-7,10-14,22H,1H3,(H,24,26)