4-(5-iodanyl-7-phenyl-heptyl)-1,2-dimethoxy-benzene

Systemtic Name: 4-(5-iodanyl-7-phenyl-heptyl)-1,2-dimethoxy-benzene Openeye Name: 4-(5-iodo-7-phenyl-heptyl)-1,2-dimethoxy-benzene CAS Name: 4-(5-iodo-7-phenylheptyl)-1,2-dimethoxybenzene IUPAC Name: 4-(5-iodo-7-phenylheptyl)-1,2-dimethoxybenzene Traditional Name: 4-(5-iodo-7-phenyl-heptyl)-1,2-dimethoxy-benzene Formula: C21H27IO2 MolecularWeight: 438.34235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCCCC(CCC2=CC=CC=C2)I)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCCCC(CCC2=CC=CC=C2)I)OC

InChI

InChI=1S/C21H27IO2/c1-23-20-15-13-18(16-21(20)24-2)10-6-7-11-19(22)14-12-17-8-4-3-5-9-17/h3-5,8-9,13,15-16,19H,6-7,10-12,14H2,1-2H3