(2S,3R)-3-acetyloxy-2-[(2S)-4-prop-2-enoxycarbonyl-2,5-dihydro-1,3-thiazol-2-yl]butanoic acid

Systemtic Name: (2S,3R)-3-acetyloxy-2-[(2S)-4-prop-2-enoxycarbonyl-2,5-dihydro-1,3-thiazol-2-yl]butanoic acid Openeye Name: (2S,3R)-3-acetoxy-2-[(2S)-4-allyloxycarbonyl-2,5-dihydrothiazol-2-yl]butanoic acid CAS Name: (2S,3R)-3-acetyloxy-2-[(2S)-4-[oxo(prop-2-enoxy)methyl]-2,5-dihydrothiazol-2-yl]butanoic acid IUPAC Name: (2S,3R)-3-acetyloxy-2-[(2S)-4-prop-2-enoxycarbonyl-2,5-dihydro-1,3-thiazol-2-yl]butanoic acid Traditional Name: (2S,3R)-3-acetoxy-2-[(2S)-4-allyloxycarbonyl-3-thiazolin-2-yl]butyric acid Formula: C13H17NO6S MolecularWeight: 315.34218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1N=C(CS1)C(=O)OCC=C)C(=O)O)OC(=O)C

Isomeric SMILES

C[C@H]([C@H]([C@H]1N=C(CS1)C(=O)OCC=C)C(=O)O)OC(=O)C

InChI

InChI=1S/C13H17NO6S/c1-4-5-19-13(18)9-6-21-11(14-9)10(12(16)17)7(2)20-8(3)15/h4,7,10-11H,1,5-6H2,2-3H3,(H,16,17)/t7-,10-,11+/m1/s1