(E)-3-[3-bromanyl-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-[3-bromanyl-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide Openeye Name: (E)-3-[3-bromo-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide CAS Name: (E)-3-[3-bromo-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(3-ethoxyphenyl)-2-propenamide IUPAC Name: (E)-3-[3-bromo-4-[(2-cyanophenyl)methoxy]phenyl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide Traditional Name: (E)-3-[3-bromo-4-(2-cyanobenzyl)oxy-phenyl]-2-cyano-N-m-phenetyl-acrylamide Formula: C26H20BrN3O3 MolecularWeight: 502.3593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3C#N)Br)C#N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)OCC3=CC=CC=C3C#N)Br)/C#N

InChI

InChI=1S/C26H20BrN3O3/c1-2-32-23-9-5-8-22(14-23)30-26(31)21(16-29)12-18-10-11-25(24(27)13-18)33-17-20-7-4-3-6-19(20)15-28/h3-14H,2,17H2,1H3,(H,30,31)/b21-12+