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

Systemtic Name: 4-chloranyl-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]benzamide Openeye Name: 4-chloro-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methyleneamino]benzamide CAS Name: 4-chloro-N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide IUPAC Name: 4-chloro-N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]benzamide Traditional Name: 4-chloro-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)benzylidene]amino]benzamide Formula: C21H13ClN4O4 MolecularWeight: 420.80532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC(=O)C2=CC=C(C=C2)Cl)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

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

InChI

InChI=1S/C21H13ClN4O4/c22-17-5-3-15(4-6-17)21(27)25-24-13-14-1-8-19(9-2-14)30-20-10-7-18(26(28)29)11-16(20)12-23/h1-11,13H,(H,25,27)/b24-13+