(E)-N-(3-bromophenyl)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(3-bromophenyl)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)prop-2-enamide Openeye Name: (E)-N-(3-bromophenyl)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(3-bromophenyl)-2-cyano-3-(2,4-dimethoxy-5-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(3-bromophenyl)-2-cyano-3-(2,4-dimethoxy-5-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(3-bromophenyl)-2-cyano-3-(2,4-dimethoxy-5-nitro-phenyl)acrylamide Formula: C18H14BrN3O5 MolecularWeight: 432.22486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C(C#N)C(=O)NC2=CC(=CC=C2)Br)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrN3O5/c1-26-16-9-17(27-2)15(22(24)25)7-11(16)6-12(10-20)18(23)21-14-5-3-4-13(19)8-14/h3-9H,1-2H3,(H,21,23)/b12-6+