(E,3S)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ene-1-sulfonic acid

Systemtic Name: (E,3S)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ene-1-sulfonic acid Openeye Name: (E,3S)-3-(tert-butoxycarbonylamino)-5-methyl-hex-1-ene-1-sulfonic acid CAS Name: (E,3S)-5-methyl-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-hexene-1-sulfonic acid IUPAC Name: (E,3S)-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hex-1-ene-1-sulfonic acid Traditional Name: (E,3S)-3-(tert-butoxycarbonylamino)-5-methyl-hex-1-ene-1-sulfonic acid Formula: C12H23NO5S MolecularWeight: 293.37972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](/C=C/S(=O)(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C12H23NO5S/c1-9(2)8-10(6-7-19(15,16)17)13-11(14)18-12(3,4)5/h6-7,9-10H,8H2,1-5H3,(H,13,14)(H,15,16,17)/b7-6+/t10-/m1/s1