1-butyl-4-(4-iodophenyl)-3,5,8-trioxabicyclo[2.2.2]octane

Systemtic Name: 1-butyl-4-(4-iodophenyl)-3,5,8-trioxabicyclo[2.2.2]octane Openeye Name: 1-butyl-4-(4-iodophenyl)-3,5,8-trioxabicyclo[2.2.2]octane CAS Name: 1-butyl-4-(4-iodophenyl)-3,5,8-trioxabicyclo[2.2.2]octane IUPAC Name: 1-butyl-4-(4-iodophenyl)-3,5,8-trioxabicyclo[2.2.2]octane Traditional Name: 1-butyl-4-(4-iodophenyl)-3,5,8-trioxabicyclo[2.2.2]octane Formula: C15H19IO3 MolecularWeight: 374.21403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC12COC(OC1)(OC2)C3=CC=C(C=C3)I

Isomeric SMILES

CCCCC12COC(OC1)(OC2)C3=CC=C(C=C3)I

InChI

InChI=1S/C15H19IO3/c1-2-3-8-14-9-17-15(18-10-14,19-11-14)12-4-6-13(16)7-5-12/h4-7H,2-3,8-11H2,1H3