methyl (E)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ene-1-sulfonate

Systemtic Name: methyl (E)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ene-1-sulfonate Openeye Name: methyl (E)-3-(tert-butoxycarbonylamino)-5-methyl-hex-1-ene-1-sulfonate CAS Name: (E)-5-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-hexene-1-sulfonic acid methyl ester IUPAC Name: methyl (E)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ene-1-sulfonate Traditional Name: (E)-3-(tert-butoxycarbonylamino)-5-methyl-hex-1-ene-1-sulfonic acid methyl ester Formula: C13H25NO5S MolecularWeight: 307.4063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=CS(=O)(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC(/C=C/S(=O)(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H25NO5S/c1-10(2)9-11(7-8-20(16,17)18-6)14-12(15)19-13(3,4)5/h7-8,10-11H,9H2,1-6H3,(H,14,15)/b8-7+