4-(4-chlorophenyl)-4-(3-iodanylpropyl)-1,3-dihydroisochromene

Systemtic Name: 4-(4-chlorophenyl)-4-(3-iodanylpropyl)-1,3-dihydroisochromene Openeye Name: 4-(4-chlorophenyl)-4-(3-iodopropyl)isochromane CAS Name: 4-(4-chlorophenyl)-4-(3-iodopropyl)-3,4-dihydro-1H-2-benzopyran IUPAC Name: 4-(4-chlorophenyl)-4-(3-iodopropyl)-1,3-dihydroisochromene Traditional Name: 4-(4-chlorophenyl)-4-(3-iodopropyl)isochroman Formula: C18H18ClIO MolecularWeight: 412.69239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(CO1)(CCCI)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2C(CO1)(CCCI)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClIO/c19-16-8-6-15(7-9-16)18(10-3-11-20)13-21-12-14-4-1-2-5-17(14)18/h1-2,4-9H,3,10-13H2