N-(3-chloranyl-4-cyano-phenyl)-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-morpholin-4-ium-4-yl-acetamide Formula: C13H15ClN3O2+ MolecularWeight: 280.7301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C13H14ClN3O2/c14-12-7-11(2-1-10(12)8-15)16-13(18)9-17-3-5-19-6-4-17/h1-2,7H,3-6,9H2,(H,16,18)/p+1