4-nitro-N-[2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]benzamide

Systemtic Name: 4-nitro-N-[2-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1-benzofuran-3-yl]benzamide Openeye Name: 4-nitro-N-[2-[4-(2-pyridyl)piperazine-1-carbonyl]benzofuran-3-yl]benzamide CAS Name: 4-nitro-N-[2-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-3-benzofuranyl]benzamide IUPAC Name: 4-nitro-N-[2-(4-pyridin-2-ylpiperazine-1-carbonyl)-1-benzofuran-3-yl]benzamide Traditional Name: 4-nitro-N-[2-[4-(2-pyridyl)piperazine-1-carbonyl]benzofuran-3-yl]benzamide Formula: C25H21N5O5 MolecularWeight: 471.46474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C3=C(C4=CC=CC=C4O3)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H21N5O5/c31-24(17-8-10-18(11-9-17)30(33)34)27-22-19-5-1-2-6-20(19)35-23(22)25(32)29-15-13-28(14-16-29)21-7-3-4-12-26-21/h1-12H,13-16H2,(H,27,31)