(2S)-2-(azocan-1-ium-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: (2S)-2-(azocan-1-ium-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: (2S)-2-(azocan-1-ium-1-yl)-N-(5-methylisoxazol-3-yl)propanamide CAS Name: (2S)-2-(1-azocan-1-iumyl)-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: (2S)-2-(azocan-1-ium-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: (2S)-2-(azocan-1-ium-1-yl)-N-(5-methylisoxazol-3-yl)propionamide Formula: C14H24N3O2+ MolecularWeight: 266.35926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)[NH+]2CCCCCCC2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)[NH+]2CCCCCCC2

InChI

InChI=1S/C14H23N3O2/c1-11-10-13(16-19-11)15-14(18)12(2)17-8-6-4-3-5-7-9-17/h10,12H,3-9H2,1-2H3,(H,15,16,18)/p+1/t12-/m0/s1