5-(4-methylhexyl)-4-(3-oct-7-enoxy-4-phenyl-phenyl)-1,3-dioxane

Systemtic Name: 5-(4-methylhexyl)-4-(3-oct-7-enoxy-4-phenyl-phenyl)-1,3-dioxane Openeye Name: 5-(4-methylhexyl)-4-(3-oct-7-enoxy-4-phenyl-phenyl)-1,3-dioxane CAS Name: 5-(4-methylhexyl)-4-(3-oct-7-enoxy-4-phenylphenyl)-1,3-dioxane IUPAC Name: 5-(4-methylhexyl)-4-(3-oct-7-enoxy-4-phenylphenyl)-1,3-dioxane Traditional Name: 5-(4-methylhexyl)-4-(3-oct-7-enoxy-4-phenyl-phenyl)-1,3-dioxane Formula: C31H44O3 MolecularWeight: 464.67926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCC1COCOC1C2=CC(=C(C=C2)C3=CC=CC=C3)OCCCCCCC=C

Isomeric SMILES

CCC(C)CCCC1COCOC1C2=CC(=C(C=C2)C3=CC=CC=C3)OCCCCCCC=C

InChI

InChI=1S/C31H44O3/c1-4-6-7-8-9-13-21-33-30-22-27(19-20-29(30)26-16-11-10-12-17-26)31-28(23-32-24-34-31)18-14-15-25(3)5-2/h4,10-12,16-17,19-20,22,25,28,31H,1,5-9,13-15,18,21,23-24H2,2-3H3