4-(hexadecoxymethyl)-2-phenyl-1,3-dioxane

Systemtic Name: 4-(hexadecoxymethyl)-2-phenyl-1,3-dioxane Openeye Name: 4-(hexadecoxymethyl)-2-phenyl-1,3-dioxane CAS Name: 4-(hexadecoxymethyl)-2-phenyl-1,3-dioxane IUPAC Name: 4-(hexadecoxymethyl)-2-phenyl-1,3-dioxane Traditional Name: 4-(cetyloxymethyl)-2-phenyl-1,3-dioxane Formula: C27H46O3 MolecularWeight: 418.65234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC1CCOC(O1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC1CCOC(O1)C2=CC=CC=C2

InChI

InChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-22-28-24-26-21-23-29-27(30-26)25-19-16-15-17-20-25/h15-17,19-20,26-27H,2-14,18,21-24H2,1H3