[(2R,3S,6R)-3-oxidanyl-6-propyl-oxan-2-yl]methyl benzoate

Systemtic Name: [(2R,3S,6R)-3-oxidanyl-6-propyl-oxan-2-yl]methyl benzoate Openeye Name: [(2R,3S,6R)-3-hydroxy-6-propyl-tetrahydropyran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3S,6R)-3-hydroxy-6-propyl-2-oxanyl]methyl ester IUPAC Name: [(2R,3S,6R)-3-hydroxy-6-propyloxan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3S,6R)-3-hydroxy-6-propyl-tetrahydropyran-2-yl]methyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(C(O1)COC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCC[C@@H]1CC[C@@H]([C@H](O1)COC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H22O4/c1-2-6-13-9-10-14(17)15(20-13)11-19-16(18)12-7-4-3-5-8-12/h3-5,7-8,13-15,17H,2,6,9-11H2,1H3/t13-,14+,15-/m1/s1