[(2R,6S)-6-hexyloxan-2-yl] benzoate

Systemtic Name: [(2R,6S)-6-hexyloxan-2-yl] benzoate Openeye Name: [(2R,6S)-6-hexyltetrahydropyran-2-yl] benzoate CAS Name: benzoic acid [(2R,6S)-6-hexyl-2-oxanyl] ester IUPAC Name: [(2R,6S)-6-hexyloxan-2-yl] benzoate Traditional Name: benzoic acid [(2R,6S)-6-hexyltetrahydropyran-2-yl] ester Formula: C18H26O3 MolecularWeight: 290.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCCC(O1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H26O3/c1-2-3-4-8-12-16-13-9-14-17(20-16)21-18(19)15-10-6-5-7-11-15/h5-7,10-11,16-17H,2-4,8-9,12-14H2,1H3/t16-,17+/m0/s1