(2R)-2-bromanyl-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide

Systemtic Name: (2R)-2-bromanyl-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamide Openeye Name: (2R)-2-bromo-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide CAS Name: (2R)-2-bromo-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide IUPAC Name: (2R)-2-bromo-2-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide Traditional Name: (2R)-2-bromo-2-cyano-N-homoveratryl-acetamide Formula: C13H15BrN2O3 MolecularWeight: 327.1738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C(C#N)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)[C@@H](C#N)Br)OC

InChI

InChI=1S/C13H15BrN2O3/c1-18-11-4-3-9(7-12(11)19-2)5-6-16-13(17)10(14)8-15/h3-4,7,10H,5-6H2,1-2H3,(H,16,17)/t10-/m1/s1