7-heptoxy-4,4-dimethyl-2,3-dihydrothiochromene

Systemtic Name: 7-heptoxy-4,4-dimethyl-2,3-dihydrothiochromene Openeye Name: 7-heptoxy-4,4-dimethyl-thiochromane CAS Name: 7-heptoxy-4,4-dimethyl-2,3-dihydro-1-benzothiopyran IUPAC Name: 7-heptoxy-4,4-dimethyl-2,3-dihydrothiochromene Traditional Name: 7-heptoxy-4,4-dimethyl-thiochroman Formula: C18H28OS MolecularWeight: 292.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1)C(CCS2)(C)C

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1)C(CCS2)(C)C

InChI

InChI=1S/C18H28OS/c1-4-5-6-7-8-12-19-15-9-10-16-17(14-15)20-13-11-18(16,2)3/h9-10,14H,4-8,11-13H2,1-3H3