methyl (1S,3R,4R,5S)-1,3,4-tris(oxidanyl)-5-prop-2-enyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,3R,4R,5S)-1,3,4-tris(oxidanyl)-5-prop-2-enyl-cyclohexane-1-carboxylate Openeye Name: methyl (1S,3S,4R,5R)-3-allyl-1,4,5-trihydroxy-cyclohexanecarboxylate CAS Name: (1S,3R,4R,5S)-1,3,4-trihydroxy-5-prop-2-enyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,3R,4R,5S)-1,3,4-trihydroxy-5-prop-2-enylcyclohexane-1-carboxylate Traditional Name: (1S,3S,4R,5R)-3-allyl-1,4,5-trihydroxy-cyclohexanecarboxylic acid methyl ester Formula: C11H18O5 MolecularWeight: 230.25762

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(C(C(C1)O)O)CC=C)O

Isomeric SMILES

COC(=O)[C@@]1(C[C@@H]([C@H]([C@@H](C1)O)O)CC=C)O

InChI

InChI=1S/C11H18O5/c1-3-4-7-5-11(15,10(14)16-2)6-8(12)9(7)13/h3,7-9,12-13,15H,1,4-6H2,2H3/t7-,8+,9+,11-/m0/s1