(E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-N-butyl-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-N-butyl-2-cyano-prop-2-enamide Openeye Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-N-butyl-2-cyano-prop-2-enamide CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-N-butyl-2-cyano-2-propenamide IUPAC Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-N-butyl-2-cyanoprop-2-enamide Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-N-butyl-2-cyano-acrylamide Formula: C15H17BrN2O3 MolecularWeight: 353.21108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC(=C(C=C1Br)OC)O)C#N

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=CC(=C(C=C1Br)OC)O)/C#N

InChI

InChI=1S/C15H17BrN2O3/c1-3-4-5-18-15(20)11(9-17)6-10-7-13(19)14(21-2)8-12(10)16/h6-8,19H,3-5H2,1-2H3,(H,18,20)/b11-6+