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

Systemtic Name: 5-bromanyl-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methylideneamino]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)phenyl]methyleneamino]-2-methoxy-benzamide CAS Name: 5-bromo-N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylideneamino]-2-methoxybenzamide Traditional Name: 5-bromo-N-[(E)-[4-(2-cyano-4-nitro-phenoxy)benzylidene]amino]-2-methoxy-benzamide Formula: C22H15BrN4O5 MolecularWeight: 495.2823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NN=CC2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)N/N=C/C2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C22H15BrN4O5/c1-31-21-8-4-16(23)11-19(21)22(28)26-25-13-14-2-6-18(7-3-14)32-20-9-5-17(27(29)30)10-15(20)12-24/h2-11,13H,1H3,(H,26,28)/b25-13+