(3R)-3-methyl-5-oxidanylidene-5-(2-piperidin-1-ium-1-ylethylamino)pentanoate

Systemtic Name: (3R)-3-methyl-5-oxidanylidene-5-(2-piperidin-1-ium-1-ylethylamino)pentanoate Openeye Name: (3R)-3-methyl-5-oxo-5-(2-piperidin-1-ium-1-ylethylamino)pentanoate CAS Name: (3R)-3-methyl-5-oxo-5-[2-(1-piperidin-1-iumyl)ethylamino]pentanoate IUPAC Name: (3R)-3-methyl-5-oxo-5-(2-piperidin-1-ium-1-ylethylamino)pentanoate Traditional Name: (3R)-5-keto-3-methyl-5-(2-piperidin-1-ium-1-ylethylamino)valerate Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC[NH+]1CCCCC1)CC(=O)[O-]

Isomeric SMILES

C[C@H](CC(=O)NCC[NH+]1CCCCC1)CC(=O)[O-]

InChI

InChI=1S/C13H24N2O3/c1-11(10-13(17)18)9-12(16)14-5-8-15-6-3-2-4-7-15/h11H,2-10H2,1H3,(H,14,16)(H,17,18)/t11-/m1/s1