(2S)-N-(tert-butylcarbamoyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(tert-butylcarbamoyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-(tert-butylcarbamoyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-[(tert-butylamino)-oxomethyl]-2-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(tert-butylcarbamoyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(tert-butylcarbamoyl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propionamide Formula: C15H30N3O2+ MolecularWeight: 284.4176

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)C(C)C(=O)NC(=O)NC(C)(C)C)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)[C@@H](C)C(=O)NC(=O)NC(C)(C)C)C

InChI

InChI=1S/C15H29N3O2/c1-10-7-11(2)9-18(8-10)12(3)13(19)16-14(20)17-15(4,5)6/h10-12H,7-9H2,1-6H3,(H2,16,17,19,20)/p+1/t10-,11-,12+/m1/s1