ethyl 2-[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-2-yl]ethanoate

Systemtic Name: ethyl 2-[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-2-yl]ethanoate Openeye Name: ethyl 2-[(2R,3S)-3-(tert-butoxycarbonylamino)piperidin-1-ium-2-yl]acetate CAS Name: 2-[(2R,3S)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-piperidin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-2-yl]acetate Traditional Name: 2-[(2R,3S)-3-(tert-butoxycarbonylamino)piperidin-1-ium-2-yl]acetic acid ethyl ester Formula: C14H27N2O4+ MolecularWeight: 287.37518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(CCC[NH2+]1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C[C@@H]1[C@H](CCC[NH2+]1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C14H26N2O4/c1-5-19-12(17)9-11-10(7-6-8-15-11)16-13(18)20-14(2,3)4/h10-11,15H,5-9H2,1-4H3,(H,16,18)/p+1/t10-,11+/m0/s1