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

Systemtic Name: (E)-3-(3-bromanyl-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-3-(3-bromo-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(p-tolyl)prop-2-enamide CAS Name: (E)-3-(3-bromo-5-methoxy-4-propoxyphenyl)-2-cyano-N-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(3-bromo-5-methoxy-4-propoxyphenyl)-2-cyano-N-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(3-bromo-5-methoxy-4-propoxy-phenyl)-2-cyano-N-(p-tolyl)acrylamide Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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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)C)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN2O3/c1-4-9-27-20-18(22)11-15(12-19(20)26-3)10-16(13-23)21(25)24-17-7-5-14(2)6-8-17/h5-8,10-12H,4,9H2,1-3H3,(H,24,25)/b16-10+