ethyl (3S)-1-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-1-[2-[[2-(methylamino)-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-1-[2-[[2-(methylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-[[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[2-keto-2-[[2-keto-2-(methylamino)ethyl]amino]ethyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C13H24N3O4+ MolecularWeight: 286.34736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O4/c1-3-20-13(19)10-5-4-6-16(8-10)9-12(18)15-7-11(17)14-2/h10H,3-9H2,1-2H3,(H,14,17)(H,15,18)/p+1/t10-/m0/s1