(3S)-1-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperidin-1-ium-3-carboxylate

Systemtic Name: (3S)-1-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperidin-1-ium-3-carboxylate Openeye Name: (3S)-1-[2-(allylamino)-2-oxo-ethyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[2-oxo-2-(prop-2-enylamino)ethyl]-3-piperidin-1-iumcarboxylate IUPAC Name: (3S)-1-[2-oxo-2-(prop-2-enylamino)ethyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[2-(allylamino)-2-keto-ethyl]piperidin-1-ium-3-carboxylate Formula: C11H18N2O3 MolecularWeight: 226.27222

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C[NH+]1CCCC(C1)C(=O)[O-]

Isomeric SMILES

C=CCNC(=O)C[NH+]1CCC[C@@H](C1)C(=O)[O-]

InChI

InChI=1S/C11H18N2O3/c1-2-5-12-10(14)8-13-6-3-4-9(7-13)11(15)16/h2,9H,1,3-8H2,(H,12,14)(H,15,16)/t9-/m0/s1