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

Systemtic Name: 3-(2-bromanyl-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Openeye Name: 3-(2-bromo-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(m-tolyl)prop-2-enamide CAS Name: 3-(2-bromo-5-ethoxy-4-propoxyphenyl)-2-cyano-N-(3-methylphenyl)-2-propenamide IUPAC Name: 3-(2-bromo-5-ethoxy-4-propoxyphenyl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Traditional Name: 3-(2-bromo-5-ethoxy-4-propoxy-phenyl)-2-cyano-N-(m-tolyl)acrylamide Formula: C22H23BrN2O3 MolecularWeight: 443.33362

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Br)C=C(C#N)C(=O)NC2=CC=CC(=C2)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Br)C=C(C#N)C(=O)NC2=CC=CC(=C2)C)OCC

InChI

InChI=1S/C22H23BrN2O3/c1-4-9-28-21-13-19(23)16(12-20(21)27-5-2)11-17(14-24)22(26)25-18-8-6-7-15(3)10-18/h6-8,10-13H,4-5,9H2,1-3H3,(H,25,26)