3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-iodophenyl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-iodophenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-iodophenyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-iodophenyl)methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-iodophenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-iodophenyl)methanone Formula: C16H13IO3 MolecularWeight: 380.17709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)I)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)C3=CC=C(C=C3)I)OC1

InChI

InChI=1S/C16H13IO3/c17-13-5-2-11(3-6-13)16(18)12-4-7-14-15(10-12)20-9-1-8-19-14/h2-7,10H,1,8-9H2