N-[(1R,2R,5S,6S)-4-bromanyl-5,6-bis(oxidanyl)-2-pentan-3-yloxy-cyclohex-3-en-1-yl]ethanamide

Systemtic Name: N-[(1R,2R,5S,6S)-4-bromanyl-5,6-bis(oxidanyl)-2-pentan-3-yloxy-cyclohex-3-en-1-yl]ethanamide Openeye Name: N-[(1R,2R,5S,6S)-4-bromo-2-(1-ethylpropoxy)-5,6-dihydroxy-cyclohex-3-en-1-yl]acetamide CAS Name: N-[(1R,2R,5S,6S)-4-bromo-5,6-dihydroxy-2-pentan-3-yloxy-1-cyclohex-3-enyl]acetamide IUPAC Name: N-[(1R,2R,5S,6S)-4-bromo-5,6-dihydroxy-2-pentan-3-yloxycyclohex-3-en-1-yl]acetamide Traditional Name: N-[(1R,2R,5S,6S)-4-bromo-2-(1-ethylpropoxy)-5,6-dihydroxy-cyclohex-3-en-1-yl]acetamide Formula: C13H22BrNO4 MolecularWeight: 336.22208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(C(C(C1NC(=O)C)O)O)Br

Isomeric SMILES

CCC(CC)O[C@@H]1C=C([C@H]([C@H]([C@H]1NC(=O)C)O)O)Br

InChI

InChI=1S/C13H22BrNO4/c1-4-8(5-2)19-10-6-9(14)12(17)13(18)11(10)15-7(3)16/h6,8,10-13,17-18H,4-5H2,1-3H3,(H,15,16)/t10-,11+,12-,13+/m1/s1