3-iodanyl-5-methoxy-4-phenethyloxy-benzenecarbonitrile

Systemtic Name: 3-iodanyl-5-methoxy-4-phenethyloxy-benzenecarbonitrile Openeye Name: 3-iodo-5-methoxy-4-phenethyloxy-benzonitrile CAS Name: 3-iodo-5-methoxy-4-phenethyloxybenzonitrile IUPAC Name: 3-iodo-5-methoxy-4-phenethyloxybenzonitrile Traditional Name: 3-iodo-5-methoxy-4-phenethyloxy-benzonitrile Formula: C16H14INO2 MolecularWeight: 379.19233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C#N)I)OCCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)C#N)I)OCCC2=CC=CC=C2

InChI

InChI=1S/C16H14INO2/c1-19-15-10-13(11-18)9-14(17)16(15)20-8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3