methyl 8-[(3R,4R,6S)-4-chloranyl-6-hexyl-oxan-3-yl]octanoate

Systemtic Name: methyl 8-[(3R,4R,6S)-4-chloranyl-6-hexyl-oxan-3-yl]octanoate Openeye Name: methyl 8-[(3R,4R,6S)-4-chloro-6-hexyl-tetrahydropyran-3-yl]octanoate CAS Name: 8-[(3R,4R,6S)-4-chloro-6-hexyl-3-oxanyl]octanoic acid methyl ester IUPAC Name: methyl 8-[(3R,4R,6S)-4-chloro-6-hexyloxan-3-yl]octanoate Traditional Name: 8-[(3R,4R,6S)-4-chloro-6-hexyl-tetrahydropyran-3-yl]caprylic acid methyl ester Formula: C20H37ClO3 MolecularWeight: 360.95898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(C(CO1)CCCCCCCC(=O)OC)Cl

Isomeric SMILES

CCCCCC[C@H]1C[C@H]([C@@H](CO1)CCCCCCCC(=O)OC)Cl

InChI

InChI=1S/C20H37ClO3/c1-3-4-5-10-13-18-15-19(21)17(16-24-18)12-9-7-6-8-11-14-20(22)23-2/h17-19H,3-16H2,1-2H3/t17-,18+,19-/m1/s1