(1S,2R,4R,5R)-4-oxidanyl-5-propoxy-cyclohexane-1,2-dicarboxylic acid

Systemtic Name: (1S,2R,4R,5R)-4-oxidanyl-5-propoxy-cyclohexane-1,2-dicarboxylic acid Openeye Name: (1S,2R,4R,5R)-4-hydroxy-5-propoxy-cyclohexane-1,2-dicarboxylic acid CAS Name: (1S,2R,4R,5R)-4-hydroxy-5-propoxycyclohexane-1,2-dicarboxylic acid IUPAC Name: (1S,2R,4R,5R)-4-hydroxy-5-propoxycyclohexane-1,2-dicarboxylic acid Traditional Name: (1S,2R,4R,5R)-4-hydroxy-5-propoxy-cyclohexane-1,2-dicarboxylic acid Formula: C11H18O6 MolecularWeight: 246.25702

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1CC(C(CC1O)C(=O)O)C(=O)O

Isomeric SMILES

CCCO[C@@H]1C[C@@H]([C@@H](C[C@H]1O)C(=O)O)C(=O)O

InChI

InChI=1S/C11H18O6/c1-2-3-17-9-5-7(11(15)16)6(10(13)14)4-8(9)12/h6-9,12H,2-5H2,1H3,(H,13,14)(H,15,16)/t6-,7+,8-,9-/m1/s1