3-bromanyl-N-[(E)-[3-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]benzamide

Systemtic Name: 3-bromanyl-N-[(E)-[3-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]benzamide Openeye Name: 3-bromo-N-[(E)-[3-(2-cyano-4-nitro-phenoxy)phenyl]methyleneamino]benzamide CAS Name: 3-bromo-N-[(E)-[3-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide IUPAC Name: 3-bromo-N-[(E)-[3-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide Traditional Name: 3-bromo-N-[(E)-[3-(2-cyano-4-nitro-phenoxy)benzylidene]amino]benzamide Formula: C21H13BrN4O4 MolecularWeight: 465.25632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C=NNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)/C=N/NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H13BrN4O4/c22-17-5-2-4-15(10-17)21(27)25-24-13-14-3-1-6-19(9-14)30-20-8-7-18(26(28)29)11-16(20)12-23/h1-11,13H,(H,25,27)/b24-13+