methyl (3S,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-3-carboxylate

Systemtic Name: methyl (3S,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-3-carboxylate Openeye Name: methyl (3S,4R)-4-(tert-butoxycarbonylamino)piperidin-1-ium-3-carboxylate CAS Name: (3S,4R)-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-ium-3-carboxylate Traditional Name: (3S,4R)-4-(tert-butoxycarbonylamino)piperidin-1-ium-3-carboxylic acid methyl ester Formula: C12H23N2O4+ MolecularWeight: 259.32202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CC[NH2+]CC1C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CC[NH2+]C[C@@H]1C(=O)OC

InChI

InChI=1S/C12H22N2O4/c1-12(2,3)18-11(16)14-9-5-6-13-7-8(9)10(15)17-4/h8-9,13H,5-7H2,1-4H3,(H,14,16)/p+1/t8-,9+/m0/s1