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

Systemtic Name: 5-(hexadecoxymethyl)-2-phenyl-1,3-dioxane Openeye Name: 5-(hexadecoxymethyl)-2-phenyl-1,3-dioxane CAS Name: 5-(hexadecoxymethyl)-2-phenyl-1,3-dioxane IUPAC Name: 5-(hexadecoxymethyl)-2-phenyl-1,3-dioxane Traditional Name: 5-(cetyloxymethyl)-2-phenyl-1,3-dioxane Formula: C27H46O3 MolecularWeight: 418.65234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC1COC(OC1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC1COC(OC1)C2=CC=CC=C2

InChI

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