(E)-2-(4-bromophenyl)carbonyl-3-(methylamino)but-2-enenitrile

Systemtic Name: (E)-2-(4-bromophenyl)carbonyl-3-(methylamino)but-2-enenitrile Openeye Name: (E)-2-(4-bromobenzoyl)-3-(methylamino)but-2-enenitrile CAS Name: (E)-2-[(4-bromophenyl)-oxomethyl]-3-(methylamino)-2-butenenitrile IUPAC Name: (E)-2-(4-bromobenzoyl)-3-(methylamino)but-2-enenitrile Traditional Name: (E)-2-(4-bromobenzoyl)-3-(methylamino)but-2-enenitrile Formula: C12H11BrN2O MolecularWeight: 279.13254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)C1=CC=C(C=C1)Br)NC

Isomeric SMILES

C/C(=C(/C#N)\C(=O)C1=CC=C(C=C1)Br)/NC

InChI

InChI=1S/C12H11BrN2O/c1-8(15-2)11(7-14)12(16)9-3-5-10(13)6-4-9/h3-6,15H,1-2H3/b11-8+