3-(5-bromanyl-2-butoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: 3-(5-bromanyl-2-butoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Openeye Name: 3-(5-bromo-2-butoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide CAS Name: 3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: 3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: 3-(5-bromo-2-butoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide Formula: C21H21BrN2O3 MolecularWeight: 429.30704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=CC=C(C=C2)OC

InChI

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