N-(3-tert-butyl-1,2-oxazol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-(3-tert-butylisoxazol-5-yl)-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-(3-tert-butyl-5-isoxazolyl)-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-(3-tert-butylisoxazol-5-yl)-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C13H22N3O2+ MolecularWeight: 252.33268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)C[NH+]2CCCC2

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)C[NH+]2CCCC2

InChI

InChI=1S/C13H21N3O2/c1-13(2,3)10-8-12(18-15-10)14-11(17)9-16-6-4-5-7-16/h8H,4-7,9H2,1-3H3,(H,14,17)/p+1