ethyl (3R)-1-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-[2-oxo-2-(propylcarbamoylamino)ethyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[2-oxo-2-(propylcarbamoylamino)ethyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-[2-keto-2-(propylcarbamoylamino)ethyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C14H26N3O4+ MolecularWeight: 300.37394

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)C[NH+]1CCCC(C1)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C14H25N3O4/c1-3-7-15-14(20)16-12(18)10-17-8-5-6-11(9-17)13(19)21-4-2/h11H,3-10H2,1-2H3,(H2,15,16,18,20)/p+1/t11-/m1/s1