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

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

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

Canonical SMILES:

C1CCC(NCC1)CCCCCCOC2=CC=CC3=C2SCCC3


Isomeric SMILES

C1CCC(NCC1)CCCCCCOC2=CC=CC3=C2SCCC3


InChI

InChI=1S/C21H33NOS/c1(4-12-19-13-5-3-6-15-22-19)2-7-16-23-20-14-8-10-18-11-9-17-24-21(18)20/h8,10,14,19,22H,1-7,9,11-13,15-17H2


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