N-[3,5-bis(fluoranyl)phenyl]-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide

Systemtic Name: N-[3,5-bis(fluoranyl)phenyl]-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide Openeye Name: N-(3,5-difluorophenyl)-3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]benzamide CAS Name: N-(3,5-difluorophenyl)-3-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]benzamide IUPAC Name: N-(3,5-difluorophenyl)-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide Traditional Name: N-(3,5-difluorophenyl)-3-nitro-4-[4-(2-pyridyl)piperazino]benzamide Formula: C22H19F2N5O3 MolecularWeight: 439.414766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NC3=CC(=CC(=C3)F)F)[N+](=O)[O-])C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NC3=CC(=CC(=C3)F)F)[N+](=O)[O-])C4=CC=CC=N4

InChI

InChI=1S/C22H19F2N5O3/c23-16-12-17(24)14-18(13-16)26-22(30)15-4-5-19(20(11-15)29(31)32)27-7-9-28(10-8-27)21-3-1-2-6-25-21/h1-6,11-14H,7-10H2,(H,26,30)