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

Systemtic Name: 2-bromanyl-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]benzamide Openeye Name: 2-bromo-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methyleneamino]benzamide CAS Name: 2-bromo-N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide IUPAC Name: 2-bromo-N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide Traditional Name: 2-bromo-N-[(E)-[4-(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=C(C(=C1)C(=O)NN=CC2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/N=C/C2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N)Br

InChI

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