4-bromanyl-1-(3-chloranylpropyl)-1-methyl-3,4-dihydroisothiochromen-6-ol

Systemtic Name: 4-bromanyl-1-(3-chloranylpropyl)-1-methyl-3,4-dihydroisothiochromen-6-ol Openeye Name: 4-bromo-1-(3-chloropropyl)-1-methyl-isothiochroman-6-ol CAS Name: 4-bromo-1-(3-chloropropyl)-1-methyl-3,4-dihydro-2-benzothiopyran-6-ol IUPAC Name: 4-bromo-1-(3-chloropropyl)-1-methyl-3,4-dihydroisothiochromen-6-ol Traditional Name: 4-bromo-1-(3-chloropropyl)-1-methyl-isothiochroman-6-ol Formula: C13H16BrClOS MolecularWeight: 335.68754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)O)C(CS1)Br)CCCCl

Isomeric SMILES

CC1(C2=C(C=C(C=C2)O)C(CS1)Br)CCCCl

InChI

InChI=1S/C13H16BrClOS/c1-13(5-2-6-15)11-4-3-9(16)7-10(11)12(14)8-17-13/h3-4,7,12,16H,2,5-6,8H2,1H3