(E)-3-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3-bromanyl-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide Openeye Name: (E)-3-(3-bromo-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide CAS Name: (E)-3-(3-bromo-5-ethoxy-4-propoxyphenyl)-2-cyano-N-(4-hydroxyphenyl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-ethoxy-4-propoxyphenyl)-2-cyano-N-(4-hydroxyphenyl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(4-hydroxyphenyl)acrylamide Formula: C21H21BrN2O4 MolecularWeight: 445.30644

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=C(C#N)C(=O)NC2=CC=C(C=C2)O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)O)OCC

InChI

InChI=1S/C21H21BrN2O4/c1-3-9-28-20-18(22)11-14(12-19(20)27-4-2)10-15(13-23)21(26)24-16-5-7-17(25)8-6-16/h5-8,10-12,25H,3-4,9H2,1-2H3,(H,24,26)/b15-10+