N-(2-cyanophenyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-cyanophenyl)-2-[(2R)-2-(5-methylisoxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(2-cyanophenyl)-2-[(2R)-2-(5-methyl-3-isoxazolyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(2-cyanophenyl)-2-[(2R)-2-(5-methylisoxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide Formula: C17H19N4O2+ MolecularWeight: 311.35836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2CCC[NH+]2CC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC(=NO1)[C@H]2CCC[NH+]2CC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C17H18N4O2/c1-12-9-15(20-23-12)16-7-4-8-21(16)11-17(22)19-14-6-3-2-5-13(14)10-18/h2-3,5-6,9,16H,4,7-8,11H2,1H3,(H,19,22)/p+1/t16-/m1/s1