1-[5-[(2,6-dimethylphenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl benzoate

Systemtic Name: 1-[5-[(2,6-dimethylphenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl benzoate Openeye Name: 1-[5-[(2,6-dimethylphenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl benzoate CAS Name: benzoic acid 1-[5-[(2,6-dimethylphenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl ester IUPAC Name: 1-[5-[(2,6-dimethylphenyl)methoxy]-2-propyl-1,3-dioxan-4-yl]ethyl benzoate Traditional Name: benzoic acid 1-[5-(2,6-dimethylbenzyl)oxy-2-propyl-1,3-dioxan-4-yl]ethyl ester Formula: C25H32O5 MolecularWeight: 412.51858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1OCC(C(O1)C(C)OC(=O)C2=CC=CC=C2)OCC3=C(C=CC=C3C)C

Isomeric SMILES

CCCC1OCC(C(O1)C(C)OC(=O)C2=CC=CC=C2)OCC3=C(C=CC=C3C)C

InChI

InChI=1S/C25H32O5/c1-5-10-23-28-16-22(27-15-21-17(2)11-9-12-18(21)3)24(30-23)19(4)29-25(26)20-13-7-6-8-14-20/h6-9,11-14,19,22-24H,5,10,15-16H2,1-4H3