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

Systemtic Name: 3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: N-benzyl-2-cyano-3-(3,5-dibromo-4-hydroxy-phenyl)prop-2-enamide CAS Name: 2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: N-benzyl-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)prop-2-enamide Traditional Name: N-benzyl-2-cyano-3-(3,5-dibromo-4-hydroxy-phenyl)acrylamide Formula: C17H12Br2N2O2 MolecularWeight: 436.09738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=CC(=C(C(=C2)Br)O)Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(=CC2=CC(=C(C(=C2)Br)O)Br)C#N

InChI

InChI=1S/C17H12Br2N2O2/c18-14-7-12(8-15(19)16(14)22)6-13(9-20)17(23)21-10-11-4-2-1-3-5-11/h1-8,22H,10H2,(H,21,23)