(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: (2S)-N-(5-methylisoxazol-3-yl)-2-phenyl-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: (2S)-N-(5-methyl-3-isoxazolyl)-2-phenyl-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: (2S)-N-(5-methylisoxazol-3-yl)-2-phenyl-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCCC3

InChI

InChI=1S/C16H19N3O2/c1-12-11-14(18-21-12)17-16(20)15(19-9-5-6-10-19)13-7-3-2-4-8-13/h2-4,7-8,11,15H,5-6,9-10H2,1H3,(H,17,18,20)/p+1/t15-/m0/s1