(E)-N-(4-acetamidophenyl)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-N-(4-acetamidophenyl)-3-(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-cyano-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-3-(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-3-(4-allyloxy-3-bromo-5-methoxy-phenyl)-2-cyano-acrylamide Formula: C22H20BrN3O4 MolecularWeight: 470.3159

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)Br)OCC=C)OC)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C(=C2)Br)OCC=C)OC)/C#N

InChI

InChI=1S/C22H20BrN3O4/c1-4-9-30-21-19(23)11-15(12-20(21)29-3)10-16(13-24)22(28)26-18-7-5-17(6-8-18)25-14(2)27/h4-8,10-12H,1,9H2,2-3H3,(H,25,27)(H,26,28)/b16-10+