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

Systemtic Name: ethyl (3R)-1-[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-[2-(cyclopentylcarbamoylamino)-2-oxo-ethyl]piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-[2-[[(cyclopentylamino)-oxomethyl]amino]-2-oxoethyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-[2-(cyclopentylcarbamoylamino)-2-oxoethyl]piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-[2-(cyclopentylcarbamoylamino)-2-keto-ethyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C16H28N3O4+ MolecularWeight: 326.41122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC(=O)NC(=O)NC2CCCC2

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CC(=O)NC(=O)NC2CCCC2

InChI

InChI=1S/C16H27N3O4/c1-2-23-15(21)12-6-5-9-19(10-12)11-14(20)18-16(22)17-13-7-3-4-8-13/h12-13H,2-11H2,1H3,(H2,17,18,20,22)/p+1/t12-/m1/s1