1-(4-iodophenyl)hexyl hydrogen carbonate

Systemtic Name: 1-(4-iodophenyl)hexyl hydrogen carbonate Openeye Name: 1-(4-iodophenyl)hexyl hydrogen carbonate CAS Name: carbonic acid 1-(4-iodophenyl)hexyl ester IUPAC Name: 1-(4-iodophenyl)hexyl hydrogen carbonate Traditional Name: carbonic acid 1-(4-iodophenyl)hexyl ester Formula: C13H17IO3 MolecularWeight: 348.17675

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)I)OC(=O)O

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)I)OC(=O)O

InChI

InChI=1S/C13H17IO3/c1-2-3-4-5-12(17-13(15)16)10-6-8-11(14)9-7-10/h6-9,12H,2-5H2,1H3,(H,15,16)