(2S)-N-(3-methylbutyl)-2-[(3S)-piperidin-1-ium-3-yl]oxy-propanamide

Systemtic Name: (2S)-N-(3-methylbutyl)-2-[(3S)-piperidin-1-ium-3-yl]oxy-propanamide Openeye Name: (2S)-N-isopentyl-2-[(3S)-piperidin-1-ium-3-yl]oxy-propanamide CAS Name: (2S)-N-(3-methylbutyl)-2-[[(3S)-3-piperidin-1-iumyl]oxy]propanamide IUPAC Name: (2S)-N-(3-methylbutyl)-2-[(3S)-piperidin-1-ium-3-yl]oxypropanamide Traditional Name: (2S)-N-isoamyl-2-[(3S)-piperidin-1-ium-3-yl]oxy-propionamide Formula: C13H27N2O2+ MolecularWeight: 243.36568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)OC1CCC[NH2+]C1

Isomeric SMILES

C[C@@H](C(=O)NCCC(C)C)O[C@H]1CCC[NH2+]C1

InChI

InChI=1S/C13H26N2O2/c1-10(2)6-8-15-13(16)11(3)17-12-5-4-7-14-9-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)/p+1/t11-,12-/m0/s1