(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(2-iodanylphenyl)methanone

Systemtic Name: (7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(2-iodanylphenyl)methanone Openeye Name: (7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(2-iodophenyl)methanone CAS Name: (7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(2-iodophenyl)methanone IUPAC Name: (7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(2-iodophenyl)methanone Traditional Name: (7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(2-iodophenyl)methanone Formula: C16H12ClIO3 MolecularWeight: 414.62215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(=O)C3=CC=CC=C3I)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(=O)C3=CC=CC=C3I)Cl)OC1

InChI

InChI=1S/C16H12ClIO3/c17-12-9-15-14(20-6-3-7-21-15)8-11(12)16(19)10-4-1-2-5-13(10)18/h1-2,4-5,8-9H,3,6-7H2