ethyl (3R,4R,5S)-4-azanyl-5-oxidanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate

Systemtic Name: ethyl (3R,4R,5S)-4-azanyl-5-oxidanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate Openeye Name: ethyl (3R,4R,5S)-4-amino-3-(1-ethylpropoxy)-5-hydroxy-cyclohexene-1-carboxylate CAS Name: (3R,4R,5S)-4-amino-5-hydroxy-3-pentan-3-yloxy-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4R,5S)-4-amino-5-hydroxy-3-pentan-3-yloxycyclohexene-1-carboxylate Traditional Name: (3R,4R,5S)-4-amino-3-(1-ethylpropoxy)-5-hydroxy-cyclohexene-1-carboxylic acid ethyl ester Formula: C14H25NO4 MolecularWeight: 271.3526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC(C1N)O)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C14H25NO4/c1-4-10(5-2)19-12-8-9(14(17)18-6-3)7-11(16)13(12)15/h8,10-13,16H,4-7,15H2,1-3H3/t11-,12+,13+/m0/s1