(E)-3-(5-bromanyl-3-iodanyl-2-oxidanyl-phenyl)-2-cyano-N-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-3-iodanyl-2-oxidanyl-phenyl)-2-cyano-N-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-hydroxy-3-iodo-phenyl)-2-cyano-N-(p-tolyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-hydroxy-3-iodophenyl)-2-cyano-N-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-hydroxy-3-iodophenyl)-2-cyano-N-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-hydroxy-3-iodo-phenyl)-2-cyano-N-(p-tolyl)acrylamide Formula: C17H12BrIN2O2 MolecularWeight: 483.09785

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=CC(=C2O)I)Br)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=CC(=C2O)I)Br)/C#N

InChI

InChI=1S/C17H12BrIN2O2/c1-10-2-4-14(5-3-10)21-17(23)12(9-20)6-11-7-13(18)8-15(19)16(11)22/h2-8,22H,1H3,(H,21,23)/b12-6+