1-[5-[(2-chlorophenyl)methoxy]-2-hexyl-1,3-dioxan-4-yl]ethyl benzoate

Systemtic Name: 1-[5-[(2-chlorophenyl)methoxy]-2-hexyl-1,3-dioxan-4-yl]ethyl benzoate Openeye Name: 1-[5-[(2-chlorophenyl)methoxy]-2-hexyl-1,3-dioxan-4-yl]ethyl benzoate CAS Name: benzoic acid 1-[5-[(2-chlorophenyl)methoxy]-2-hexyl-1,3-dioxan-4-yl]ethyl ester IUPAC Name: 1-[5-[(2-chlorophenyl)methoxy]-2-hexyl-1,3-dioxan-4-yl]ethyl benzoate Traditional Name: benzoic acid 1-[5-(2-chlorobenzyl)oxy-2-hexyl-1,3-dioxan-4-yl]ethyl ester Formula: C26H33ClO5 MolecularWeight: 460.99022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1OCC(C(O1)C(C)OC(=O)C2=CC=CC=C2)OCC3=CC=CC=C3Cl

Isomeric SMILES

CCCCCCC1OCC(C(O1)C(C)OC(=O)C2=CC=CC=C2)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C26H33ClO5/c1-3-4-5-9-16-24-30-18-23(29-17-21-14-10-11-15-22(21)27)25(32-24)19(2)31-26(28)20-12-7-6-8-13-20/h6-8,10-15,19,23-25H,3-5,9,16-18H2,1-2H3