(3S,6R)-2,2,6-trimethyl-6-[(1R)-2-methyl-1-oxidanyl-propyl]oxane-3-carboxylate

Systemtic Name: (3S,6R)-2,2,6-trimethyl-6-[(1R)-2-methyl-1-oxidanyl-propyl]oxane-3-carboxylate Openeye Name: (3S,6R)-6-[(1R)-1-hydroxy-2-methyl-propyl]-2,2,6-trimethyl-tetrahydropyran-3-carboxylate CAS Name: (3S,6R)-6-[(1R)-1-hydroxy-2-methylpropyl]-2,2,6-trimethyl-3-oxanecarboxylate IUPAC Name: (3S,6R)-6-[(1R)-1-hydroxy-2-methylpropyl]-2,2,6-trimethyloxane-3-carboxylate Traditional Name: (3S,6R)-6-[(1R)-1-hydroxy-2-methyl-propyl]-2,2,6-trimethyl-tetrahydropyran-3-carboxylate Formula: C13H23O4- MolecularWeight: 243.31932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1(CCC(C(O1)(C)C)C(=O)[O-])C)O

Isomeric SMILES

CC(C)[C@H]([C@]1(CC[C@@H](C(O1)(C)C)C(=O)[O-])C)O

InChI

InChI=1S/C13H24O4/c1-8(2)10(14)13(5)7-6-9(11(15)16)12(3,4)17-13/h8-10,14H,6-7H2,1-5H3,(H,15,16)/p-1/t9-,10-,13-/m1/s1