(2S)-N-(3-methylbutyl)-2-(4-oxidanylidenepiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(3-methylbutyl)-2-(4-oxidanylidenepiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-isopentyl-2-(4-oxopiperidin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(3-methylbutyl)-2-(4-oxo-1-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-N-(3-methylbutyl)-2-(4-oxopiperidin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-isoamyl-2-(4-ketopiperidin-1-ium-1-yl)propionamide Formula: C13H25N2O2+ MolecularWeight: 241.3498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)[NH+]1CCC(=O)CC1

Isomeric SMILES

C[C@@H](C(=O)NCCC(C)C)[NH+]1CCC(=O)CC1

InChI

InChI=1S/C13H24N2O2/c1-10(2)4-7-14-13(17)11(3)15-8-5-12(16)6-9-15/h10-11H,4-9H2,1-3H3,(H,14,17)/p+1/t11-/m0/s1