methyl (1R,4S,5R)-4-acetamido-5-acetyloxy-1-oxidanyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (1R,4S,5R)-4-acetamido-5-acetyloxy-1-oxidanyl-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1R,4S,5R)-4-acetamido-5-acetoxy-1-hydroxy-cyclohex-2-ene-1-carboxylate CAS Name: (1R,4S,5R)-4-acetamido-5-acetyloxy-1-hydroxy-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,4S,5R)-4-acetamido-5-acetyloxy-1-hydroxycyclohex-2-ene-1-carboxylate Traditional Name: (1R,4S,5R)-4-acetamido-5-acetoxy-1-hydroxy-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C12H17NO6 MolecularWeight: 271.26648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C=CC(CC1OC(=O)C)(C(=O)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO6/c1-7(14)13-9-4-5-12(17,11(16)18-3)6-10(9)19-8(2)15/h4-5,9-10,17H,6H2,1-3H3,(H,13,14)/t9-,10+,12-/m0/s1