methyl 2-methyl-5-(3-phenoxypropyl)-1,3-dioxane-2-carboxylate

Systemtic Name: methyl 2-methyl-5-(3-phenoxypropyl)-1,3-dioxane-2-carboxylate Openeye Name: methyl 2-methyl-5-(3-phenoxypropyl)-1,3-dioxane-2-carboxylate CAS Name: 2-methyl-5-(3-phenoxypropyl)-1,3-dioxane-2-carboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-(3-phenoxypropyl)-1,3-dioxane-2-carboxylate Traditional Name: 2-methyl-5-(3-phenoxypropyl)-1,3-dioxane-2-carboxylic acid methyl ester Formula: C16H22O5 MolecularWeight: 294.34288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CCCOC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1(OCC(CO1)CCCOC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H22O5/c1-16(15(17)18-2)20-11-13(12-21-16)7-6-10-19-14-8-4-3-5-9-14/h3-5,8-9,13H,6-7,10-12H2,1-2H3