(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-piperidin-1-ium-4-yl-propanoate

Systemtic Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-piperidin-1-ium-4-yl-propanoate Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-3-piperidin-1-ium-4-yl-propanoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-piperidin-1-iumyl)propanoate IUPAC Name: (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-piperidin-1-ium-4-ylpropanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-piperidin-1-ium-4-yl-propionate Formula: C13H24N2O4 MolecularWeight: 272.34066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1CC[NH2+]CC1)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1CC[NH2+]CC1)C(=O)[O-]

InChI

InChI=1S/C13H24N2O4/c1-13(2,3)19-12(18)15-10(11(16)17)8-9-4-6-14-7-5-9/h9-10,14H,4-8H2,1-3H3,(H,15,18)(H,16,17)/t10-/m0/s1