(E)-3-(5-bromanyl-2-prop-2-enoxy-phenyl)-2-cyano-N-(2-methyl-4-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-prop-2-enoxy-phenyl)-2-cyano-N-(2-methyl-4-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(2-allyloxy-5-bromo-phenyl)-2-cyano-N-(2-methyl-4-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-prop-2-enoxyphenyl)-2-cyano-N-(2-methyl-4-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-prop-2-enoxyphenyl)-2-cyano-N-(2-methyl-4-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(2-allyloxy-5-bromo-phenyl)-2-cyano-N-(2-methyl-4-nitro-phenyl)acrylamide Formula: C20H16BrN3O4 MolecularWeight: 442.26274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(=CC2=C(C=CC(=C2)Br)OCC=C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC=C)/C#N

InChI

InChI=1S/C20H16BrN3O4/c1-3-8-28-19-7-4-16(21)11-14(19)10-15(12-22)20(25)23-18-6-5-17(24(26)27)9-13(18)2/h3-7,9-11H,1,8H2,2H3,(H,23,25)/b15-10+