1-[6-(3,4-dihydro-2H-thiochromen-8-yloxy)hexyl]azepane

Systemtic Name: 1-[6-(3,4-dihydro-2H-thiochromen-8-yloxy)hexyl]azepane Openeye Name: 1-(6-thiochroman-8-yloxyhexyl)azepane CAS Name: 1-[6-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)hexyl]azepane IUPAC Name: 1-[6-(3,4-dihydro-2H-thiochromen-8-yloxy)hexyl]azepane Traditional Name: 1-(6-thiochroman-8-yloxyhexyl)azepane Formula: C21H33NOS MolecularWeight: 347.55782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCCCCOC2=CC=CC3=C2SCCC3

Isomeric SMILES

C1CCCN(CC1)CCCCCCOC2=CC=CC3=C2SCCC3

InChI

InChI=1S/C21H33NOS/c1-2-6-15-22(14-5-1)16-7-3-4-8-17-23-20-13-9-11-19-12-10-18-24-21(19)20/h9,11,13H,1-8,10,12,14-18H2