(E,2E)-4-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]but-3-enenitrile

Systemtic Name: (E,2E)-4-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]but-3-enenitrile Openeye Name: (E,2E)-4-(3-nitrophenyl)-2-[(3-nitrophenyl)methylene]but-3-enenitrile CAS Name: (E,2E)-4-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]-3-butenenitrile IUPAC Name: (E,2E)-4-(3-nitrophenyl)-2-[(3-nitrophenyl)methylidene]but-3-enenitrile Traditional Name: (E,2E)-2-(3-nitrobenzylidene)-4-(3-nitrophenyl)but-3-enenitrile Formula: C17H11N3O4 MolecularWeight: 321.28694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=CC2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C17H11N3O4/c18-12-15(9-14-4-2-6-17(11-14)20(23)24)8-7-13-3-1-5-16(10-13)19(21)22/h1-11H/b8-7+,15-9+