pentyl 4-[(3R,6R)-6-hexyl-2-oxidanylidene-oxan-3-yl]oxybenzoate

Systemtic Name: pentyl 4-[(3R,6R)-6-hexyl-2-oxidanylidene-oxan-3-yl]oxybenzoate Openeye Name: pentyl 4-[(3R,6R)-6-hexyl-2-oxo-tetrahydropyran-3-yl]oxybenzoate CAS Name: 4-[[(3R,6R)-6-hexyl-2-oxo-3-oxanyl]oxy]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(3R,6R)-6-hexyl-2-oxooxan-3-yl]oxybenzoate Traditional Name: 4-[(3R,6R)-6-hexyl-2-keto-tetrahydropyran-3-yl]oxybenzoic acid amyl ester Formula: C23H34O5 MolecularWeight: 390.51306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(C(=O)O1)OC2=CC=C(C=C2)C(=O)OCCCCC

Isomeric SMILES

CCCCCC[C@@H]1CC[C@H](C(=O)O1)OC2=CC=C(C=C2)C(=O)OCCCCC

InChI

InChI=1S/C23H34O5/c1-3-5-7-8-10-19-15-16-21(23(25)28-19)27-20-13-11-18(12-14-20)22(24)26-17-9-6-4-2/h11-14,19,21H,3-10,15-17H2,1-2H3/t19-,21-/m1/s1