N1,N3-bis(4-cyanophenyl)-5-nitro-benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis(4-cyanophenyl)-5-nitro-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(4-cyanophenyl)-5-nitro-benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(4-cyanophenyl)-5-nitrobenzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(4-cyanophenyl)-5-nitrobenzene-1,3-dicarboxamide Traditional Name: N,N'-bis(4-cyanophenyl)-5-nitro-isophthalamide Formula: C22H13N5O4 MolecularWeight: 411.36972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H13N5O4/c23-12-14-1-5-18(6-2-14)25-21(28)16-9-17(11-20(10-16)27(30)31)22(29)26-19-7-3-15(13-24)4-8-19/h1-11H,(H,25,28)(H,26,29)