(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-(2-chloranyl-5-nitro-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-(2-chloranyl-5-nitro-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-(2-chloro-5-nitro-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-(2-chloro-5-nitrophenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-(2-chloro-5-nitrophenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-(2-chloro-5-nitro-phenyl)-2-cyano-acrylamide Formula: C17H11BrClN3O4 MolecularWeight: 436.64394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11BrClN3O4/c1-26-16-5-2-12(18)7-10(16)6-11(9-20)17(23)21-15-8-13(22(24)25)3-4-14(15)19/h2-8H,1H3,(H,21,23)/b11-6+