(2S)-2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: (2S)-2-(4-ethanoylpiperazin-1-ium-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: (2S)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(5-methylisoxazol-3-yl)propanamide CAS Name: (2S)-2-(4-acetyl-1-piperazin-1-iumyl)-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: (2S)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: (2S)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(5-methylisoxazol-3-yl)propionamide Formula: C13H21N4O3+ MolecularWeight: 281.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C13H20N4O3/c1-9-8-12(15-20-9)14-13(19)10(2)16-4-6-17(7-5-16)11(3)18/h8,10H,4-7H2,1-3H3,(H,14,15,19)/p+1/t10-/m0/s1