(E)-3-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-3-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-2-cyano-3-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-2-cyano-3-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-benzyl-2-cyano-3-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)acrylamide Formula: C18H14Br2N2O3 MolecularWeight: 466.12336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C=C(C#N)C(=O)NCC2=CC=CC=C2)Br)Br)O

Isomeric SMILES

COC1=C(C(=C(C(=C1)/C=C(\C#N)/C(=O)NCC2=CC=CC=C2)Br)Br)O

InChI

InChI=1S/C18H14Br2N2O3/c1-25-14-8-12(15(19)16(20)17(14)23)7-13(9-21)18(24)22-10-11-5-3-2-4-6-11/h2-8,23H,10H2,1H3,(H,22,24)/b13-7+