sodium 3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-butane-1-sulfonate

Systemtic Name: sodium 3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanyl-butane-1-sulfonate Openeye Name: sodium 3-(tert-butoxycarbonylamino)-4-hydroxy-butane-1-sulfonate CAS Name: sodium 4-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-butanesulfonate IUPAC Name: sodium 4-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]butane-1-sulfonate Traditional Name: sodium 3-(tert-butoxycarbonylamino)-4-hydroxy-butane-1-sulfonate Formula: C9H18NNaO6S MolecularWeight: 291.29709

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCS(=O)(=O)[O-])CO.[Na+]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCS(=O)(=O)[O-])CO.[Na+]

InChI

InChI=1S/C9H19NO6S.Na/c1-9(2,3)16-8(12)10-7(6-11)4-5-17(13,14)15;/h7,11H,4-6H2,1-3H3,(H,10,12)(H,13,14,15);/q;+1/p-1