3-[7-(3-iodanylpropoxy)-8-propyl-3,4-dihydro-2H-chromen-2-yl]propanoic acid

Systemtic Name: 3-[7-(3-iodanylpropoxy)-8-propyl-3,4-dihydro-2H-chromen-2-yl]propanoic acid Openeye Name: 3-[7-(3-iodopropoxy)-8-propyl-chroman-2-yl]propanoic acid CAS Name: 3-[7-(3-iodopropoxy)-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoic acid IUPAC Name: 3-[7-(3-iodopropoxy)-8-propyl-3,4-dihydro-2H-chromen-2-yl]propanoic acid Traditional Name: 3-[7-(3-iodopropoxy)-8-propyl-chroman-2-yl]propionic acid Formula: C18H25IO4 MolecularWeight: 432.29317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)CCC(=O)O)OCCCI

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)CCC(=O)O)OCCCI

InChI

InChI=1S/C18H25IO4/c1-2-4-15-16(22-12-3-11-19)9-6-13-5-7-14(23-18(13)15)8-10-17(20)21/h6,9,14H,2-5,7-8,10-12H2,1H3,(H,20,21)