3-chloranyl-N-[3-(2-cyanoaziridin-1-yl)-3-oxidanylidene-propyl]propanamide

Systemtic Name: 3-chloranyl-N-[3-(2-cyanoaziridin-1-yl)-3-oxidanylidene-propyl]propanamide Openeye Name: 3-chloro-N-[3-(2-cyanoaziridin-1-yl)-3-oxo-propyl]propanamide CAS Name: 3-chloro-N-[3-(2-cyano-1-aziridinyl)-3-oxopropyl]propanamide IUPAC Name: 3-chloro-N-[3-(2-cyanoaziridin-1-yl)-3-oxopropyl]propanamide Traditional Name: 3-chloro-N-[3-(2-cyanoethylenimin-1-yl)-3-keto-propyl]propionamide Formula: C9H12ClN3O2 MolecularWeight: 229.66348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=O)CCNC(=O)CCCl)C#N

Isomeric SMILES

C1C(N1C(=O)CCNC(=O)CCCl)C#N

InChI

InChI=1S/C9H12ClN3O2/c10-3-1-8(14)12-4-2-9(15)13-6-7(13)5-11/h7H,1-4,6H2,(H,12,14)