N-(5-chloranyl-2-cyano-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C13H15ClN3O+ MolecularWeight: 264.7307

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C13H14ClN3O/c14-11-4-3-10(8-15)12(7-11)16-13(18)9-17-5-1-2-6-17/h3-4,7H,1-2,5-6,9H2,(H,16,18)/p+1