(E)-3-[3-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-4-methoxy-phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-[3-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-4-methoxy-phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-[3-[(4-bromo-2-chloro-phenoxy)methyl]-4-methoxy-phenyl]-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-[3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl]-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-[3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl]-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-[3-[(4-bromo-2-chloro-phenoxy)methyl]-4-methoxy-phenyl]-2-cyano-N-isopropyl-acrylamide Formula: C21H20BrClN2O3 MolecularWeight: 463.7521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(C=C1)OC)COC2=C(C=C(C=C2)Br)Cl)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(C=C1)OC)COC2=C(C=C(C=C2)Br)Cl)/C#N

InChI

InChI=1S/C21H20BrClN2O3/c1-13(2)25-21(26)15(11-24)8-14-4-6-19(27-3)16(9-14)12-28-20-7-5-17(22)10-18(20)23/h4-10,13H,12H2,1-3H3,(H,25,26)/b15-8+